data_6uck_residue ############################ # Computer software used # ############################ 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 6uck _Structure_validation_residue.Date_analyzed 2020-02-21 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 ' 13' ' ' CYS . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.856 0.36 . . . . 0.0 110.823 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 25.2 p30 -111.49 -17.63 13.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.064 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 13.2 t -87.87 150.23 23.64 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.823 0.344 . . . . 0.0 110.67 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.57 -17.74 56.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.286 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 96.2 m -63.68 -39.24 93.82 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 121.007 -0.277 . . . . 0.0 110.742 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 51.3 t -58.64 -50.71 72.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.724 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.51 -39.87 92.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.646 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.9 m -46.34 -42.74 15.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.551 -179.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -82.65 -26.89 31.74 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.13 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.5 tpp85 -67.74 -44.79 76.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.716 0.293 . . . . 0.0 110.959 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.5 pp -69.8 -32.04 70.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.813 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.47 -45.32 88.87 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.933 -0.307 . . . . 0.0 110.655 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 29.5 m120 -65.95 -39.34 90.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.968 0.413 . . . . 0.0 110.542 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -63.99 -33.51 75.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.852 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -55.33 -62.19 1.83 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.905 0.383 . . . . 0.0 110.236 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 31.7 m -62.09 -18.26 19.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.378 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -86.72 -28.4 23.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.025 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.41 19.08 19.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.313 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.0 t -53.55 -51.69 62.11 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.491 -0.484 . . . . 0.0 110.187 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -49.75 -53.89 22.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.202 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -56.77 -43.08 80.47 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.84 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -58.14 -51.1 71.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.709 0.29 . . . . 0.0 111.377 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.83 -44.69 91.57 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 120.974 -0.631 . . . . 0.0 111.527 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.48 -40.98 96.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.739 0.305 . . . . 0.0 110.987 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.2 mt -70.09 -45.19 77.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.066 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 53.8 tp -64.79 -38.32 90.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.871 0.367 . . . . 0.0 110.471 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.6 m -55.07 -35.15 64.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.709 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 73.3 m -89.38 20.81 3.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.045 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.0 t -55.73 -21.72 20.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.807 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 45.0 p-10 -56.66 -18.04 10.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.974 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.0 p -53.4 -22.84 6.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.678 0.275 . . . . 0.0 110.807 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 148.52 -15.09 1.24 Allowed Glycine 0 CA--C 1.528 0.851 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 80.4 p -92.56 32.53 1.21 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.783 0.325 . . . . 0.0 110.593 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.2 p-10 -94.01 23.4 4.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.824 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.69 28.51 2.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.579 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 17.7 p90 -118.04 24.35 11.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.684 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -48.18 105.44 0.12 Allowed Glycine 0 CA--C 1.526 0.729 0 N-CA-C 111.061 -0.815 . . . . 0.0 111.061 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -70.58 -24.87 62.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.755 0.312 . . . . 0.0 110.724 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.4 ptt-85 -61.74 -18.4 59.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.904 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -67.54 -24.96 65.6 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.825 0.345 . . . . 0.0 110.608 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.18 -38.77 68.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.702 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.57 -30.62 17.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.492 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -63.59 -48.76 76.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.699 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 9.0 p -67.81 -39.82 82.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.572 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -48.2 -56.0 9.03 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.985 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -63.27 -32.15 73.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.961 0.41 . . . . 0.0 110.5 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -66.96 -29.23 69.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.625 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -122.95 74.63 48.05 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.701 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -68.0 -11.15 31.13 Favored 'Trans proline' 0 C--N 1.307 -1.632 0 C-N-CA 122.821 2.347 . . . . 0.0 112.549 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.9 tt -58.78 -42.49 89.14 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.743 0.306 . . . . 0.0 110.487 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 18.3 p-10 -52.13 -31.31 30.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.551 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 93.5 t80 -80.45 -47.84 13.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.698 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.5 mt . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.387 -179.819 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.527 0.083 0 CA-C-O 120.753 0.311 . . . . 0.0 111.055 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -114.34 -40.36 3.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.904 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 15.3 t -51.34 145.71 7.95 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.941 0.4 . . . . 0.0 110.552 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.93 -16.79 63.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.44 -179.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 93.4 m -68.18 -36.65 79.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.797 0.332 . . . . 0.0 110.663 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 45.5 t -59.95 -48.52 81.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.691 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.0 -33.87 74.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.609 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.8 m -62.08 -47.41 84.78 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.16 -179.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -74.3 -30.93 62.29 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.934 -0.307 . . . . 0.0 111.563 -179.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.32 -24.8 36.91 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.68 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.7 tp -75.36 -40.55 57.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.491 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.04 -50.06 74.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.802 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -63.96 -41.41 97.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.891 0.376 . . . . 0.0 110.796 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -67.61 -30.38 69.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.865 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -59.91 -62.14 2.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.927 0.394 . . . . 0.0 110.176 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 28.2 m -65.23 -21.85 30.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.245 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -84.51 -25.66 28.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.334 -179.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.8 t -100.47 18.97 17.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.257 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.3 t -60.31 -50.44 73.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.195 0.521 . . . . 0.0 110.258 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 14.5 p-10 -54.38 -48.74 71.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.437 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -62.55 -42.03 99.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.891 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -47.87 -50.07 27.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.654 0.264 . . . . 0.0 111.145 -179.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.38 -37.87 95.51 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.12 -44.05 97.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.616 0.245 . . . . 0.0 110.816 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.4 mt -71.8 -44.53 68.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.888 -0.325 . . . . 0.0 110.775 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 59.2 tp -59.37 -45.56 91.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.083 0.468 . . . . 0.0 110.024 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.6 m -51.86 -25.05 7.07 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.779 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 69.5 m -91.14 25.35 2.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.76 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 15.3 t -56.73 -21.46 28.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.838 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -80.58 7.68 9.5 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.405 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.3 p -89.98 20.02 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-O 120.815 0.34 . . . . 0.0 110.76 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 115.7 -15.19 17.07 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 111.327 -0.709 . . . . 0.0 111.327 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 80.3 p -102.18 33.58 3.03 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.762 0.315 . . . . 0.0 110.616 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.3 p-10 -91.39 22.71 3.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.784 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.9 m -93.41 28.34 2.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.591 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -99.43 18.65 17.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.954 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.5 108.9 0.51 Allowed Glycine 0 CA--C 1.525 0.689 0 N-CA-C 111.029 -0.828 . . . . 0.0 111.029 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -72.6 -25.74 61.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.829 0.347 . . . . 0.0 110.705 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 34.8 ptt-85 -65.53 -15.09 62.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.11 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -82.34 -32.39 29.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.788 0.327 . . . . 0.0 110.575 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.51 -44.26 89.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.978 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.8 p -72.78 -28.57 27.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.766 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -57.52 -46.78 83.42 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.686 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -68.91 -32.53 54.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.464 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.9 mp -54.77 -54.31 43.76 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.951 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -69.48 -28.13 65.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.935 0.398 . . . . 0.0 110.623 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -65.82 -37.01 85.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.888 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -119.07 75.2 14.33 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.666 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -71.15 -7.08 20.61 Favored 'Trans proline' 0 C--N 1.305 -1.711 0 C-N-CA 122.656 2.237 . . . . 0.0 112.522 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 tt -66.8 -42.88 85.23 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.787 0.327 . . . . 0.0 110.626 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -67.02 -30.82 71.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.593 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -76.5 -44.36 35.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.58 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 90.2 mt . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.296 179.9 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.936 0.398 . . . . 0.0 110.696 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -110.74 -32.38 6.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.72 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.4 t -47.96 145.14 3.15 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.939 0.399 . . . . 0.0 110.811 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.25 -21.97 66.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.204 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 92.8 m -70.85 -41.6 71.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.853 0.359 . . . . 0.0 110.746 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 50.9 t -62.08 -47.65 83.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.774 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.51 -36.07 81.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.915 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.5 m -49.44 -45.62 46.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.375 -179.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -69.38 -27.81 65.63 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.876 -0.329 . . . . 0.0 111.248 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.5 tpp85 -74.65 -52.51 11.48 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.735 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.6 pp -68.96 -33.92 74.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.649 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.04 -46.6 85.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.73 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 31.3 m-20 -64.13 -39.95 95.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.867 0.365 . . . . 0.0 110.74 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -62.44 -31.62 72.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.773 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -64.1 -61.91 1.96 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.272 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.4 m -63.6 -18.45 22.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.629 -179.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -92.71 -26.9 17.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.259 -179.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.3 t -104.87 19.3 20.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.168 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 44.6 t -58.14 -51.2 70.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.027 0.442 . . . . 0.0 110.486 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -52.03 -51.85 54.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.551 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -60.7 -42.03 96.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.647 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -53.06 -48.61 67.55 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.001 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.02 -38.22 96.24 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 -179.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.22 -44.14 97.75 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.685 0.279 . . . . 0.0 110.804 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.9 mt -72.23 -46.36 58.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.977 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 61.1 tp -58.25 -45.89 86.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.02 0.438 . . . . 0.0 110.261 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.8 m -49.47 -27.72 4.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.832 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 71.2 m -91.92 31.66 1.22 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.7 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.4 t -67.22 -8.92 35.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.267 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.2 p-10 -82.56 9.53 9.17 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 120.917 -0.313 . . . . 0.0 111.299 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 p -89.48 19.7 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-O 120.812 0.339 . . . . 0.0 110.776 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 115.56 -17.12 16.35 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 111.235 -0.746 . . . . 0.0 111.235 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 81.7 p -94.74 29.71 2.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.832 0.349 . . . . 0.0 110.569 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -92.81 23.6 4.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.738 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.7 m -92.82 28.5 2.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.581 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -119.24 25.12 10.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.646 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -48.58 114.09 1.84 Allowed Glycine 0 CA--C 1.526 0.73 0 N-CA-C 111.091 -0.804 . . . . 0.0 111.091 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -66.89 -33.73 76.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.775 0.322 . . . . 0.0 110.662 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.3 ptt-85 -61.31 -16.24 43.77 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.051 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -82.59 -25.34 33.32 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.824 0.345 . . . . 0.0 110.654 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.87 -42.51 93.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.805 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.3 p -77.8 -28.85 15.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.779 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -64.51 -45.98 84.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.661 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.0 p -73.61 -36.24 46.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.672 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -48.32 -49.92 32.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.043 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 40.3 mmtm -63.28 -40.32 97.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.921 0.391 . . . . 0.0 110.488 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -69.43 -21.96 63.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.791 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -114.92 74.59 3.53 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.626 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -67.52 -6.8 17.45 Favored 'Trans proline' 0 C--N 1.307 -1.625 0 C-N-CA 122.79 2.327 . . . . 0.0 112.473 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.4 tt -61.18 -42.15 98.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.729 0.3 . . . . 0.0 110.401 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 34.5 p-10 -54.67 -25.25 25.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.582 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -74.79 -47.56 30.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.505 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.0 mt . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.353 -179.958 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 49.1 m . . . . . 0 N--CA 1.47 0.538 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.0 p30 -106.63 30.63 5.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.602 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.2 t -148.87 150.55 33.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.594 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.53 -21.4 64.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.068 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 98.4 m -58.96 -38.48 79.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.783 0.325 . . . . 0.0 110.675 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 47.7 t -58.51 -44.54 89.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.716 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.57 -39.65 91.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.685 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 98.8 m -59.63 -48.67 80.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.577 -179.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -75.28 -30.96 60.58 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.717 -178.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.17 -22.98 38.53 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.897 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 63.3 tp -74.41 -45.17 48.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.601 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.82 -44.53 86.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.977 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.73 -41.69 98.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.789 0.328 . . . . 0.0 110.804 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -66.98 -36.68 82.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.811 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -58.68 -62.01 2.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.331 -179.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.4 m -54.53 -19.48 3.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.482 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -97.19 -18.92 18.97 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.267 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.5 t -104.44 19.39 20.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.053 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 41.8 t -54.15 -51.96 62.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.865 0.364 . . . . 0.0 110.382 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 -48.9 -52.23 25.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.411 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.7 m120 -60.14 -41.83 93.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.522 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -56.92 -49.45 75.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.774 0.321 . . . . 0.0 110.715 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.36 -41.63 99.38 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.889 -0.885 . . . . 0.0 110.889 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.75 -44.18 97.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.706 0.289 . . . . 0.0 111.049 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 80.7 mt -70.82 -45.97 70.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.167 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 57.7 tp -61.48 -43.72 98.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.869 0.366 . . . . 0.0 110.556 -179.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.7 m -52.32 -24.37 7.42 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.859 -179.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 72.4 m -90.79 35.85 0.9 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.783 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.0 t -85.68 48.82 1.65 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.673 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.4 p-10 -78.49 0.8 24.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.176 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 10.0 p -65.08 -25.47 37.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 CA-C-O 120.824 0.345 . . . . 0.0 110.671 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 117.86 22.61 3.88 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 111.126 -0.79 . . . . 0.0 111.126 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 78.8 p -110.32 28.23 8.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.794 0.33 . . . . 0.0 110.563 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 48.9 p-10 -95.93 26.45 4.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.575 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.2 m -91.4 24.48 2.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.771 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 41.7 p90 -120.3 24.27 10.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.601 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -55.91 147.3 30.08 Favored Glycine 0 CA--C 1.525 0.656 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -62.81 -37.2 85.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.702 0.287 . . . . 0.0 110.591 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.1 ptt-85 -66.13 -18.26 65.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.006 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -73.66 -25.34 60.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.749 0.309 . . . . 0.0 110.579 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -57.69 -40.63 79.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.778 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -75.21 -30.67 23.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.608 -179.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -61.69 -49.01 78.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.724 0.297 . . . . 0.0 110.797 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 10.3 p -70.78 -39.99 76.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.603 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -48.46 -56.17 8.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.064 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -65.34 -33.91 77.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.974 0.416 . . . . 0.0 110.635 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -63.49 -35.24 79.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.822 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -114.19 75.17 3.05 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.789 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -68.02 -9.49 25.87 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 C-N-CA 122.752 2.301 . . . . 0.0 112.498 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.0 tt -60.23 -42.43 95.19 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.766 0.317 . . . . 0.0 110.394 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 24.0 p-10 -50.41 -29.9 11.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.484 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -74.69 -44.62 49.23 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.618 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.5 mt . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.288 -179.99 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.855 0.359 . . . . 0.0 110.654 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -120.09 -36.49 3.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.755 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.6 t -67.24 145.46 55.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.697 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.13 -17.58 28.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.215 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 96.0 m -63.23 -38.71 92.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.739 0.304 . . . . 0.0 110.688 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 52.4 t -59.15 -50.17 75.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.601 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.16 -39.09 89.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.664 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 97.5 m -47.94 -46.11 31.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.358 -179.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -68.72 -28.24 66.65 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.838 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.3 tpp85 -72.22 -44.28 63.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.878 0.37 . . . . 0.0 110.535 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 62.6 tp -57.93 -46.7 84.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.637 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.98 -45.84 71.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.74 -179.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -68.19 -40.55 82.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.908 0.385 . . . . 0.0 110.564 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -64.91 -27.35 68.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.926 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -61.34 -61.7 2.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.376 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 32.8 m -69.4 -18.38 22.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.478 -179.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -80.63 -38.03 29.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.838 0.352 . . . . 0.0 110.74 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.9 t -94.67 18.82 10.88 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.237 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.7 t -58.84 -48.45 81.29 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.108 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -50.43 -56.4 11.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.074 179.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -56.74 -44.89 82.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.885 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -55.23 -54.5 42.59 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.705 0.288 . . . . 0.0 111.313 -179.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.69 -38.4 94.49 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 111.356 -0.697 . . . . 0.0 111.356 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.72 -40.7 95.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.807 0.337 . . . . 0.0 110.667 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.404 HG21 HD11 ' A' ' 37' ' ' ILE . 78.4 mt -68.2 -43.53 84.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.997 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 56.8 tp -65.42 -41.67 93.32 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.154 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.7 m -59.23 -35.22 73.26 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.501 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 52.5 m -91.56 35.39 0.95 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.673 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.9 t -56.72 -20.94 24.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.932 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 47.1 p-10 -56.21 -18.33 9.99 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.014 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.2 p -51.89 -25.18 5.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 120.731 0.301 . . . . 0.0 110.721 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 148.11 -14.48 1.3 Allowed Glycine 0 CA--C 1.528 0.864 0 N-CA-C 111.459 -0.656 . . . . 0.0 111.459 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 81.6 p -91.94 34.0 1.03 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.757 0.313 . . . . 0.0 110.68 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 44.7 p-10 -73.96 -0.81 17.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.375 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.5 m -92.13 28.12 1.98 Allowed 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.73 0.3 . . . . 0.0 110.606 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 13.0 p90 -98.53 19.27 14.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.924 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.59 102.64 0.06 OUTLIER Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm -80.18 -23.04 41.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.776 0.322 . . . . 0.0 110.661 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.1 ptt-85 -59.55 -19.01 45.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.946 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -62.61 -25.83 68.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.77 0.319 . . . . 0.0 110.608 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -54.73 -38.23 66.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.695 -179.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -76.83 -30.35 18.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.631 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -63.18 -51.01 68.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.665 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 9.2 p -65.62 -39.27 84.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.502 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -47.74 -56.03 8.26 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.812 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 40.5 mmtm -62.8 -35.34 79.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.935 0.398 . . . . 0.0 110.441 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.0 tmt_? -61.91 -37.49 84.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.601 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -110.66 76.11 1.11 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.509 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -64.57 -14.9 47.11 Favored 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.64 2.227 . . . . 0.0 112.409 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.2 tt -53.18 -41.41 65.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.425 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 30.2 p-10 -48.79 -29.97 5.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.582 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -74.72 -47.86 29.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.684 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.1 mt . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.396 -179.857 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.869 0.366 . . . . 0.0 110.498 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -120.86 -36.52 3.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.699 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 13.3 t -61.2 145.28 51.72 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.538 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.54 -18.95 55.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.508 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 93.4 m -65.13 -39.83 93.6 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.782 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 52.3 t -63.3 -48.87 76.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.665 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.18 -39.07 91.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.609 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 89.9 m -48.63 -41.41 31.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.235 -179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -80.13 -26.4 39.45 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.123 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -70.93 -55.06 9.22 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.603 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.5 pp -61.01 -31.38 71.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.6 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.28 -41.58 89.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.71 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -62.83 -39.82 95.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.859 0.362 . . . . 0.0 110.625 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -65.01 -28.36 69.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.859 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -65.81 -61.78 1.87 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.73 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.2 m -68.52 -18.53 23.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.193 -179.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -85.48 -34.18 21.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.886 0.374 . . . . 0.0 110.526 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.6 t -96.39 19.05 12.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.161 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.1 t -57.99 -45.04 87.43 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.178 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -53.31 -55.14 27.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.117 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -57.48 -46.3 83.86 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.979 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -56.29 -54.74 41.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.692 0.282 . . . . 0.0 111.395 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.23 -35.97 92.26 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 111.246 -0.741 . . . . 0.0 111.246 -179.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.29 -40.52 96.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.801 0.334 . . . . 0.0 110.628 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 76.1 mt -68.85 -43.3 82.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.128 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 65.4 tp -67.55 -42.8 82.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.972 0.415 . . . . 0.0 110.296 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.0 m -62.05 -25.47 67.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.661 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.5 m -92.04 29.91 1.52 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.821 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.9 t -92.48 30.29 1.54 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.58 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 50.8 p-10 -89.93 20.98 3.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.931 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.7 p -88.7 17.8 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.818 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 144.49 -23.34 2.02 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.049 -0.82 . . . . 0.0 111.049 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 37.8 m -98.2 33.9 2.08 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.803 0.335 . . . . 0.0 110.548 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.0 p-10 -62.19 -12.9 22.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.19 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.2 m -91.43 28.49 1.68 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.75 0.309 . . . . 0.0 110.76 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.3 p90 -95.39 19.93 10.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.795 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -53.58 137.97 37.95 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -70.24 -25.07 63.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.748 0.308 . . . . 0.0 110.679 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -60.3 -20.34 58.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.906 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 35.7 t30 -64.15 -26.71 68.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.783 0.325 . . . . 0.0 110.659 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -52.84 -39.57 62.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.738 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.25 -29.72 17.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.426 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -62.06 -51.22 68.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.594 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 8.8 p -66.84 -40.37 85.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.82 0.343 . . . . 0.0 110.584 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.09 -56.06 12.4 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.838 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm -64.0 -27.81 69.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.807 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -64.46 -38.7 91.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.776 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -114.53 75.04 3.32 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.207 0.527 . . . . 0.0 110.388 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -68.48 -17.78 43.66 Favored 'Trans proline' 0 N--CA 1.495 1.577 0 C-N-CA 122.781 2.321 . . . . 0.0 112.553 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.2 tt -54.12 -42.69 69.75 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.775 0.322 . . . . 0.0 110.592 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -55.91 -33.52 64.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.519 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -74.83 -47.81 28.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.576 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.1 mt . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.414 179.993 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.96 0.409 . . . . 0.0 110.697 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -102.6 -33.87 9.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.665 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.6 t -46.57 145.34 1.87 Allowed 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.985 -179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.85 -21.39 66.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.314 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 97.1 m -71.01 -40.36 71.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.895 0.379 . . . . 0.0 110.901 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 36.6 t -62.51 -47.61 83.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.683 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.65 -36.91 85.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.801 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.8 m -47.84 -45.39 29.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.35 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -70.19 -27.97 64.92 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.862 -0.335 . . . . 0.0 111.061 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -74.29 -56.43 4.89 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.788 -0.365 . . . . 0.0 110.713 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.5 pp -64.61 -30.65 71.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.621 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.27 -46.82 88.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.487 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -61.47 -41.2 96.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.708 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -64.52 -35.61 81.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.651 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -59.58 -53.42 58.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.118 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 32.6 m -71.06 -18.32 20.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.465 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -95.66 -12.41 25.6 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.562 -179.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.6 t -115.5 18.84 15.76 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 121.115 -0.234 . . . . 0.0 110.816 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.3 t -63.99 -46.61 83.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.265 0.555 . . . . 0.0 110.385 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -58.98 -59.13 5.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.88 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 28.1 m120 -59.68 -43.19 94.12 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.979 -179.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -52.6 -43.16 65.17 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.906 -0.317 . . . . 0.0 110.824 -179.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -59.87 -37.22 92.23 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.645 -0.982 . . . . 0.0 110.645 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.58 -43.5 93.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.721 0.296 . . . . 0.0 110.559 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 80.1 mt -69.31 -44.76 80.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.569 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 64.4 tp -55.98 -50.91 69.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.136 0.493 . . . . 0.0 109.884 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 68.9 m -47.44 -28.75 2.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.881 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 52.2 m -91.05 35.44 0.91 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.693 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.7 t -64.59 -11.25 32.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.16 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -82.1 9.08 9.2 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 120.979 -0.288 . . . . 0.0 111.283 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -89.45 19.22 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 120.954 -0.299 . . . . 0.0 110.812 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 119.23 -17.09 10.62 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 111.261 -0.736 . . . . 0.0 111.261 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 79.8 p -98.02 32.07 2.52 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.818 0.342 . . . . 0.0 110.61 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 49.6 p30 -95.24 25.44 4.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.732 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.64 28.55 1.98 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.518 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -112.71 21.31 15.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.865 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.32 132.02 25.34 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -71.06 -28.38 64.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.728 0.299 . . . . 0.0 110.608 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.4 ptt-85 -56.67 -18.36 12.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.951 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -72.14 -34.92 68.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.76 0.314 . . . . 0.0 110.551 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.88 -42.24 93.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.832 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.46 -29.91 48.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.485 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -71.26 -47.39 57.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.18 -179.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -73.39 -31.32 33.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.145 -179.322 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.7 mp -64.06 -42.64 96.94 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.923 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -67.42 -39.27 85.47 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.412 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -61.42 -25.19 67.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.533 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -107.11 80.6 0.84 Allowed Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.508 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -63.16 -9.17 16.29 Favored 'Trans proline' 0 N--CA 1.495 1.581 0 C-N-CA 122.371 2.048 . . . . 0.0 112.692 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.4 tt -58.65 -42.29 88.04 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.321 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 39.5 p-10 -75.51 -12.23 60.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.037 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -74.57 -37.11 63.05 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.857 0.36 . . . . 0.0 110.489 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.2 mt . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.31 -179.932 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 20.2 t . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.734 0.302 . . . . 0.0 110.695 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 47.2 p30 -87.46 -3.35 59.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.302 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.2 t -50.81 156.83 0.89 Allowed 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.835 0.35 . . . . 0.0 110.378 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.66 -34.89 65.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.87 -178.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 98.4 m -61.26 -50.21 73.97 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.947 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 60.6 m -68.08 -38.9 82.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.793 0.33 . . . . 0.0 110.564 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.17 -38.81 92.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.664 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.6 m -53.17 -47.39 68.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.462 -179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -78.98 -27.01 43.37 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.71 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -64.18 -51.45 63.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.546 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.3 pp -72.62 -25.65 61.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.807 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.15 -52.5 58.54 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.635 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -69.07 -36.63 77.85 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.71 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -60.59 -36.25 78.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.608 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -60.28 -51.7 68.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.021 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 27.7 m -76.04 -18.54 15.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.291 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -78.22 -41.64 33.76 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.756 0.313 . . . . 0.0 111.162 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.9 t -91.48 18.89 6.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.499 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.9 t -59.27 -50.31 74.49 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.323 -0.551 . . . . 0.0 109.964 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -48.95 -53.43 19.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.157 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -59.21 -44.73 92.26 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.606 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -51.81 -52.2 50.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.102 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -66.74 -35.63 90.02 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.347 -0.701 . . . . 0.0 111.347 -179.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.3 -41.25 98.94 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.704 0.288 . . . . 0.0 110.696 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.5 mt -72.42 -44.29 62.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.727 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 64.8 tp -60.62 -47.57 85.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.997 0.427 . . . . 0.0 110.226 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.4 t -50.04 -30.79 11.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.57 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.7 m -96.08 35.81 1.39 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.725 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.4 t -91.43 34.17 0.97 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.717 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -91.75 20.79 5.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.811 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 5.4 p -101.54 4.84 10.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.785 0.326 . . . . 0.0 110.803 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 93.01 19.3 36.93 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.11 -0.796 . . . . 0.0 111.11 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 77.8 p -109.73 32.58 4.94 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.772 0.32 . . . . 0.0 110.597 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 46.2 p-10 -99.92 26.23 6.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.702 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.76 23.92 9.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.756 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 8.9 p90 -133.12 22.58 4.12 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.652 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -60.22 145.99 46.13 Favored Glycine 0 CA--C 1.524 0.603 0 N-CA-C 110.977 -0.849 . . . . 0.0 110.977 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -64.09 -36.0 82.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.778 0.323 . . . . 0.0 110.623 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.5 ptt-85 -59.75 -20.36 56.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.725 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.37 -23.63 66.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.627 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.51 -38.84 72.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.795 -179.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -76.13 -32.61 23.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 120.819 -0.353 . . . . 0.0 110.444 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -64.63 -50.44 67.13 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.784 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.5 p -64.09 -42.53 95.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.62 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -47.94 -50.03 28.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.015 -179.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -61.28 -38.1 85.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.9 0.381 . . . . 0.0 110.522 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.8 tmt_? -65.65 -36.5 83.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.473 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -108.07 88.12 4.43 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.473 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -66.27 -5.65 13.04 Favored 'Trans proline' 0 N--CA 1.495 1.567 0 C-N-CA 122.144 1.896 . . . . 0.0 112.799 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.9 tp -60.94 -42.57 98.47 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.898 -0.321 . . . . 0.0 110.615 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -62.89 -17.34 61.53 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.937 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 55.8 t80 -74.56 -48.04 29.16 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.765 0.317 . . . . 0.0 110.321 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.1 mt . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.335 -179.876 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.916 0.388 . . . . 0.0 110.697 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -114.02 -34.32 5.44 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.744 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -46.9 146.43 1.66 Allowed 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.083 -179.672 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.83 -20.96 66.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.05 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 97.8 m -69.43 -40.46 77.23 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.81 0.338 . . . . 0.0 110.733 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.6 t -60.59 -46.27 90.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.565 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.07 -29.35 69.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.803 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.5 m -61.49 -42.23 98.47 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.584 -179.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -74.52 -32.62 62.54 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.799 -178.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.84 -24.27 31.0 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.852 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 14.2 tp -77.86 -40.76 39.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.378 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.7 -45.69 91.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.795 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -63.81 -41.75 97.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.826 0.346 . . . . 0.0 110.624 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -71.2 -28.43 64.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.738 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -60.37 -62.08 2.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.08 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.3 m -67.8 -18.57 23.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.379 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -88.58 -21.24 24.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.121 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.1 t -109.91 18.83 19.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.104 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 44.1 t -63.16 -52.46 62.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.053 0.454 . . . . 0.0 110.415 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -54.12 -57.65 10.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.837 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 29.2 m120 -58.96 -42.02 88.88 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.663 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -52.65 -41.79 64.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.18 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.8 -40.67 99.13 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.62 -42.32 87.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.724 0.297 . . . . 0.0 110.611 -179.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.4 mt -70.45 -45.73 73.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.574 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 60.7 tp -55.45 -50.92 68.58 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.944 0.402 . . . . 0.0 110.278 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.5 m -56.89 -36.0 69.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.609 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 75.1 m -90.79 35.85 0.9 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.86 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.6 t -85.22 47.93 1.49 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.858 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 16.4 p-10 -92.41 23.42 3.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.696 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.8 p -88.28 17.72 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.934 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.15 20.35 72.88 Favored Glycine 0 CA--C 1.53 0.974 0 N-CA-C 111.471 -0.651 . . . . 0.0 111.471 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 78.0 p -109.05 31.2 5.88 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.846 0.355 . . . . 0.0 110.359 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 19.8 p-10 -95.79 27.07 3.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.583 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.1 m -68.44 -14.09 62.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.695 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -90.32 20.72 4.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.618 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.19 144.84 7.77 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -62.37 -38.43 89.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.742 0.306 . . . . 0.0 110.509 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 34.8 ptt-85 -62.34 -14.18 36.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.142 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.44 -32.09 42.66 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.541 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.04 -44.6 91.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.803 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -70.2 -29.12 38.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.591 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -65.9 -46.56 77.87 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 121.007 -0.277 . . . . 0.0 110.85 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.5 p -76.62 -33.83 22.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.742 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.18 -50.82 63.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.889 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -68.61 -38.97 81.01 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.694 -0.403 . . . . 0.0 110.513 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.5 tmt_? -66.37 -22.24 66.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.677 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -108.26 82.59 1.61 Allowed Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.567 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -66.34 -5.96 13.84 Favored 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.375 2.05 . . . . 0.0 112.546 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 61.8 tp -62.74 -42.58 99.73 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -84.52 -8.02 59.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.986 179.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -74.85 -28.59 60.74 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-O 120.879 0.371 . . . . 0.0 110.525 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.8 mt . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.177 179.951 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.809 0.338 . . . . 0.0 110.7 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -104.43 -49.41 3.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.794 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.4 t -45.27 154.78 0.15 Allowed 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.013 0.435 . . . . 0.0 111.315 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.53 -18.27 62.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.288 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 99.1 m -63.39 -42.12 98.8 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.762 0.315 . . . . 0.0 110.775 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.6 t -61.85 -44.98 95.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.598 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.51 -34.18 72.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.89 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 78.7 m -62.18 -44.33 96.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.514 -179.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -72.67 -32.49 65.85 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.611 -178.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.12 -23.55 30.66 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.851 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 53.8 tp -84.01 -42.08 16.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.639 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.0 -44.49 94.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.96 -179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.8 m120 -63.5 -38.64 91.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.874 0.369 . . . . 0.0 111.111 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -70.31 -38.7 75.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.078 -179.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -66.32 -51.09 60.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.787 -179.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.9 m -58.87 -21.72 19.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.247 -179.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -97.1 -24.67 15.64 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.939 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 73.2 m -95.03 18.82 11.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.171 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.9 t -59.91 -48.44 81.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.226 0.536 . . . . 0.0 109.786 179.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -50.89 -53.14 35.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.456 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -61.76 -40.08 93.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.029 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -51.55 -40.44 59.7 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.721 -0.391 . . . . 0.0 110.569 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -59.81 -40.1 96.25 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.51 -43.47 89.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.723 0.297 . . . . 0.0 110.549 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 79.2 mt -69.87 -43.41 79.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.529 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 63.2 tp -56.94 -47.0 81.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.008 0.433 . . . . 0.0 110.151 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.0 m -48.21 -31.71 6.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.84 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 71.1 m -93.6 35.21 1.13 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.849 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.0 t -92.26 34.8 1.02 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.657 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -90.78 22.64 3.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.767 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 p -89.53 19.81 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.785 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 103.63 -13.32 53.93 Favored Glycine 0 CA--C 1.529 0.955 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 88.3 p -91.72 24.5 3.1 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.735 0.302 . . . . 0.0 110.686 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -97.8 26.59 5.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.589 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.49 24.94 2.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.719 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 30.5 p90 -116.34 22.74 12.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.72 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -59.86 155.89 29.25 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -61.6 -36.1 79.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.805 0.336 . . . . 0.0 110.624 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.3 ptt-85 -59.44 -14.91 14.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.146 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.8 t30 -79.98 -32.96 39.81 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.726 0.298 . . . . 0.0 110.571 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -57.81 -47.3 83.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.791 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 14.7 p -69.99 -31.13 46.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.67 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -64.4 -46.81 81.65 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.649 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 13.2 p -76.69 -31.93 20.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.96 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -55.47 -48.63 74.23 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 121.005 -0.278 . . . . 0.0 110.901 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -65.7 -38.56 89.56 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.3 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -63.84 -23.17 67.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.723 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -108.07 80.43 1.07 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.731 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -66.05 -6.48 14.58 Favored 'Trans proline' 0 N--CA 1.494 1.548 0 C-N-CA 122.456 2.104 . . . . 0.0 112.556 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.6 tt -57.18 -41.66 79.7 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.308 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 31.8 p-10 -70.6 -19.12 62.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.725 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -74.57 -38.44 62.68 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.621 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.6 mt . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.39 -179.938 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.855 0.36 . . . . 0.0 110.728 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 48.0 p30 -112.05 30.78 6.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.456 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.3 t -142.03 151.89 42.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.434 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.6 -20.83 58.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.148 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 95.8 m -62.0 -39.23 91.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.753 0.311 . . . . 0.0 110.826 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 50.8 t -59.37 -49.59 77.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.619 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.75 -43.36 96.68 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.731 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 79.6 m -47.6 -42.43 23.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.458 -179.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -82.94 -26.24 31.58 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.25 -28.08 53.5 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.529 -0.469 . . . . 0.0 111.543 -179.046 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.6 pp -84.65 -32.69 23.52 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.636 179.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.0 -47.71 84.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.968 -179.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -64.91 -40.25 94.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.822 0.344 . . . . 0.0 111.032 -179.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -65.09 -37.79 88.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.96 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -66.65 -57.77 6.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.577 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.1 m -54.18 -21.27 5.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.203 -179.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -97.08 -28.35 14.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.837 0.351 . . . . 0.0 110.855 -179.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.2 t -97.79 19.45 13.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.126 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 44.1 t -49.9 -48.8 51.36 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.919 0.39 . . . . 0.0 110.117 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -48.04 -51.62 23.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.346 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -59.5 -43.06 93.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.522 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -55.46 -44.11 76.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.853 0.358 . . . . 0.0 110.378 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -62.26 -40.65 99.28 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.734 -0.946 . . . . 0.0 110.734 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.62 -44.78 95.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.675 0.274 . . . . 0.0 110.961 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 82.0 mt -69.99 -46.98 71.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.963 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 49.4 tp -59.23 -45.1 92.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.007 0.432 . . . . 0.0 110.439 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 69.5 m -51.21 -25.63 5.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.859 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 68.4 m -91.53 33.09 1.02 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.745 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.7 t -91.98 34.11 1.03 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.646 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -92.73 24.89 3.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.702 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 5.4 p -91.41 23.83 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.954 0.407 . . . . 0.0 110.556 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 88.29 20.85 47.32 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 80.7 p -121.5 25.75 9.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.783 0.325 . . . . 0.0 110.556 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.6 p-10 -98.08 26.6 5.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.644 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -90.98 26.31 2.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.843 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 48.7 p90 -123.91 21.09 9.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.714 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -65.45 159.25 45.26 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -63.91 -28.03 69.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.845 0.355 . . . . 0.0 110.575 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 34.9 ptt-85 -62.39 -14.2 37.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.124 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -82.7 -30.76 28.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.733 0.302 . . . . 0.0 110.698 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.89 -43.77 91.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.914 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.7 p -75.05 -29.74 22.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.772 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -61.63 -49.59 75.95 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.805 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.1 p -71.45 -37.68 65.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.677 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -48.83 -51.43 29.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.975 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 40.3 mmtm -65.98 -38.21 87.97 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.594 -0.443 . . . . 0.0 110.484 -179.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -67.94 -22.62 65.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.841 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -107.33 82.31 1.2 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.724 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -65.48 -6.81 14.38 Favored 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.354 2.036 . . . . 0.0 112.579 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.0 tt -57.48 -42.41 82.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.796 0.332 . . . . 0.0 110.2 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 34.8 p-10 -74.22 -15.26 61.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.836 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -74.7 -29.56 61.24 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.746 0.308 . . . . 0.0 110.615 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.3 mt . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.274 -179.995 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.921 0.391 . . . . 0.0 110.605 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 16.9 p30 -108.05 -28.84 9.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.912 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.8 t -48.94 145.25 4.04 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.87 0.366 . . . . 0.0 110.669 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.73 -23.69 67.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.512 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 96.8 m -70.34 -43.88 69.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.796 0.332 . . . . 0.0 110.827 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 22.2 t -62.45 -44.35 96.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.458 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.13 -37.77 88.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.707 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 97.7 m -47.98 -43.45 29.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.199 -179.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -72.14 -26.63 62.18 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.825 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -73.52 -49.61 25.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.763 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.6 pp -73.05 -33.05 65.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.596 -179.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.26 -46.39 86.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.808 0.337 . . . . 0.0 110.368 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -60.7 -41.57 95.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.568 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -63.15 -38.65 92.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.736 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -54.65 -62.03 1.92 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.001 0.429 . . . . 0.0 110.048 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 27.8 m -63.62 -18.75 22.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.177 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -86.41 -19.46 29.64 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.024 -179.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.4 t -85.7 19.07 2.58 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.344 -179.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.1 t -61.95 -38.24 87.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.173 0.511 . . . . 0.0 110.523 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 7.7 p-10 -72.9 -51.87 16.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.454 -0.793 . . . . 0.0 111.171 -179.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -61.14 -44.3 97.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.993 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -46.07 -57.13 4.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.67 -179.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -64.37 -36.34 93.07 Favored Glycine 0 CA--C 1.526 0.732 0 C-N-CA 120.866 -0.683 . . . . 0.0 111.528 -179.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.89 -40.83 96.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.636 0.255 . . . . 0.0 110.874 -179.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.0 mt -74.17 -42.74 51.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.769 0.319 . . . . 0.0 110.71 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 65.4 tp -59.46 -50.42 74.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.143 0.497 . . . . 0.0 110.056 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.3 m -50.15 -26.9 5.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.786 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.9 m -92.16 29.49 1.63 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.732 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.2 t -59.25 -18.78 40.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.939 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 45.5 p-10 -82.11 8.89 9.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.308 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -89.02 18.42 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-O 120.717 0.294 . . . . 0.0 110.823 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 124.83 -20.45 6.79 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 111.139 -0.784 . . . . 0.0 111.139 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 70.0 p -98.48 34.12 2.09 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.81 0.338 . . . . 0.0 110.57 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -82.84 10.18 8.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.311 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.5 m -92.9 28.48 2.07 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.82 0.343 . . . . 0.0 110.516 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 12.2 p90 -101.87 19.87 17.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.904 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.92 126.61 22.39 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -71.06 -25.79 62.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.783 0.325 . . . . 0.0 110.615 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.3 ptt-85 -68.08 -19.31 64.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.001 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.91 -30.83 62.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.742 0.305 . . . . 0.0 110.691 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.34 -40.45 86.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.072 -179.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -71.9 -29.84 34.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.904 -179.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -61.13 -51.3 69.69 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.701 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 9.1 p -70.53 -41.81 78.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.495 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -50.11 -50.73 47.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.895 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm -69.3 -28.1 65.97 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.463 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -61.03 -25.82 67.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.591 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -119.04 75.78 14.53 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.531 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -66.37 -7.36 17.37 Favored 'Trans proline' 0 C--N 1.308 -1.588 0 C-N-CA 122.554 2.17 . . . . 0.0 112.494 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.3 tt -66.76 -36.94 83.62 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.271 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -84.73 -24.51 28.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.557 179.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 94.2 t80 -84.82 -24.9 28.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.691 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 64.4 mt . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.365 179.983 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 52.9 m . . . . . 0 N--CA 1.47 0.568 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -103.6 30.44 5.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.659 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.8 t -148.84 147.85 29.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.686 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.61 -20.62 34.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.124 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 97.7 m -59.4 -40.08 85.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.772 0.32 . . . . 0.0 110.704 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 54.0 t -59.22 -44.3 92.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.662 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.36 -41.94 97.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.614 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 98.7 m -59.95 -45.85 91.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.745 -179.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -78.85 -29.83 44.84 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.779 -178.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.12 -22.65 33.31 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.185 -179.633 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 52.3 tp -83.6 -41.89 17.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.799 0.333 . . . . 0.0 110.54 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.45 -43.64 93.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.867 -179.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -63.06 -39.21 94.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.812 0.339 . . . . 0.0 111.0 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -66.03 -39.55 90.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.138 -179.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -65.78 -52.16 53.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.772 -179.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.6 m -59.24 -21.74 20.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.186 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -96.01 -25.9 15.75 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.871 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.7 t -100.86 19.22 17.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.135 -179.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 41.7 t -53.21 -51.33 62.47 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.922 0.391 . . . . 0.0 110.114 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -47.93 -53.37 16.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.557 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -60.5 -40.76 92.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.661 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -55.88 -39.52 71.67 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.395 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -60.95 -40.9 99.06 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.52 -1.032 . . . . 0.0 110.52 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.78 -43.89 85.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.746 0.308 . . . . 0.0 110.746 -179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.8 mt -67.98 -43.98 85.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.731 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 60.7 tp -58.73 -48.65 80.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.893 0.377 . . . . 0.0 110.425 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 68.8 m -49.02 -32.12 8.79 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.747 -179.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.5 m -94.97 35.85 1.24 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.838 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.8 t -91.67 33.19 1.03 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.734 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.8 p-10 -86.87 14.62 6.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.06 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.1 p -64.76 -22.72 31.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.755 0.312 . . . . 0.0 110.766 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 148.53 -17.82 1.29 Allowed Glycine 0 CA--C 1.528 0.855 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 84.9 p -92.45 26.89 2.44 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.739 0.304 . . . . 0.0 110.542 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -92.3 25.81 2.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.598 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.12 28.41 1.89 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.689 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -117.34 23.93 11.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.695 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -55.43 145.7 31.09 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.009 -0.837 . . . . 0.0 111.009 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.2 mtmm -62.78 -37.88 88.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.77 0.319 . . . . 0.0 110.717 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.3 ptt-85 -62.88 -17.34 61.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.112 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -74.03 -28.79 61.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.804 0.335 . . . . 0.0 110.705 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.71 -41.45 86.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.931 -179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -73.04 -30.93 33.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.814 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -63.39 -50.75 68.65 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.643 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 9.9 p -68.94 -39.19 79.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.601 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.26 -51.34 62.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.068 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -69.61 -35.47 75.3 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.532 -179.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.8 tmt_? -61.78 -28.92 69.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.658 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -113.4 75.16 2.29 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.75 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -68.35 -5.96 16.32 Favored 'Trans proline' 0 C--N 1.307 -1.63 0 C-N-CA 122.703 2.269 . . . . 0.0 112.548 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.7 tt -62.36 -41.09 98.33 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.896 0.379 . . . . 0.0 110.267 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -63.8 -32.87 74.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.253 179.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -74.9 -38.47 61.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.689 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.7 mt . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.436 -179.928 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.1 m . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.703 0.287 . . . . 0.0 110.665 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -99.23 -44.13 6.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.638 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.9 t -47.15 153.17 0.48 Allowed 'General case' 0 C--O 1.231 0.113 0 CA-C-O 120.892 0.377 . . . . 0.0 110.991 -179.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.95 -15.15 62.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.468 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 98.3 m -68.29 -44.48 75.4 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.832 0.349 . . . . 0.0 110.687 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 10.2 t -63.38 -43.09 98.58 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.348 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.07 -36.31 82.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.85 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 64.5 m -49.12 -43.87 41.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.208 -179.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -73.47 -26.53 60.95 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.786 -0.366 . . . . 0.0 111.139 -179.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -75.83 -39.82 55.99 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.91 -0.316 . . . . 0.0 111.017 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.4 pp -84.01 -30.45 26.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.6 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.69 -47.67 84.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.475 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.3 m-20 -64.21 -40.39 95.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.725 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -64.34 -36.84 85.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.724 -179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -53.29 -61.82 2.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.182 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 27.1 m -64.42 -19.81 25.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.339 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -95.39 -0.3 52.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.655 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.9 t -118.2 16.22 14.04 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.137 -0.225 . . . . 0.0 110.872 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.9 t -64.51 -44.55 90.56 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.223 0.535 . . . . 0.0 110.41 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -58.66 -59.63 5.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.893 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -60.51 -42.19 95.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.987 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -50.16 -43.93 52.43 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.939 -0.304 . . . . 0.0 110.932 -179.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -60.81 -37.82 94.27 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.21 -42.14 90.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.587 -0.307 . . . . 0.0 110.514 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.6 mt -69.09 -42.1 81.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.499 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 63.1 tp -58.89 -52.23 66.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.092 0.472 . . . . 0.0 109.922 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.3 t -51.67 -26.2 8.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.546 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.2 m -91.98 28.6 1.8 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.643 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.7 t -85.94 46.98 1.38 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.809 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 -90.66 21.43 4.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.833 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 p -90.16 20.5 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.718 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 85.14 20.99 56.4 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 61.3 p -119.64 29.41 7.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.773 0.321 . . . . 0.0 110.547 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -96.08 26.89 3.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.556 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.8 m -91.98 28.45 1.84 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.678 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 41.2 p90 -113.98 22.64 13.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.708 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -64.6 160.44 40.8 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.049 -0.82 . . . . 0.0 111.049 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm -63.16 -31.43 72.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.822 0.344 . . . . 0.0 110.691 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.1 ptt-85 -57.96 -16.48 12.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.024 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -79.85 -26.62 40.32 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.688 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.73 -51.74 68.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.902 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 4.8 p -66.09 -30.29 49.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.563 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -64.67 -47.67 77.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.664 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.95 -29.56 15.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.994 -179.682 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.5 mp -59.67 -44.25 93.66 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.876 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -66.79 -38.86 87.36 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.273 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -63.78 -25.21 68.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.345 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -108.67 80.48 1.23 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.368 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -65.08 -7.11 14.42 Favored 'Trans proline' 0 N--CA 1.494 1.556 0 C-N-CA 122.457 2.105 . . . . 0.0 112.771 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.0 tt -58.37 -41.04 83.88 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.377 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 -71.34 -13.9 62.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.917 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -74.53 -34.4 63.0 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.884 0.373 . . . . 0.0 110.404 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.1 mt . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.382 179.971 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 49.0 m . . . . . 0 N--CA 1.469 0.499 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 23.2 p30 -103.51 30.47 4.97 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.49 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 10.6 t -146.03 149.64 34.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.684 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.91 -22.09 65.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.211 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 97.4 m -60.29 -39.2 86.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.927 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 50.4 t -58.94 -48.28 82.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.764 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.63 -43.65 98.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.726 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.3 m -48.58 -42.86 35.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.305 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -82.95 -26.35 31.46 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -179.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.48 -27.79 61.58 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.616 -0.434 . . . . 0.0 111.55 -179.046 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.4 pp -84.51 -29.24 26.14 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.701 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.1 -50.27 74.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.67 -179.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -63.59 -42.52 98.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.919 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -62.13 -39.15 91.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.946 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -66.56 -61.53 1.93 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.546 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 24.3 m -55.46 -20.97 8.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.294 -179.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -97.13 -21.85 17.09 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.225 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.2 t -97.19 19.1 13.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.28 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 41.5 t -55.42 -53.05 61.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.035 0.445 . . . . 0.0 109.848 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -48.01 -51.23 24.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.44 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -61.3 -40.13 93.01 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.841 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -53.47 -39.05 64.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.777 0.322 . . . . 0.0 110.637 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.98 -43.87 96.78 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 110.569 -1.012 . . . . 0.0 110.569 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.34 -43.14 92.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.711 0.291 . . . . 0.0 110.818 -179.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.5 mt -66.56 -47.59 83.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.879 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 63.3 tp -58.97 -45.64 90.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.897 0.379 . . . . 0.0 110.51 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 71.1 m -49.52 -29.77 7.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.729 -179.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 68.5 m -94.06 34.13 1.28 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.739 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.5 t -92.6 31.18 1.39 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.617 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 43.3 p-10 -94.06 23.49 4.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.741 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 p -89.34 19.71 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.806 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 112.05 -18.61 23.69 Favored Glycine 0 CA--C 1.527 0.792 0 N-CA-C 111.192 -0.763 . . . . 0.0 111.192 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 87.3 p -92.06 24.9 3.06 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.809 0.337 . . . . 0.0 110.63 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 50.3 p-10 -96.58 26.89 4.14 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.652 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.4 m -87.94 19.51 3.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.068 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 12.9 p90 -116.71 22.44 12.69 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.799 0.333 . . . . 0.0 110.55 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -58.79 153.93 28.54 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -61.79 -36.23 80.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.792 0.329 . . . . 0.0 110.692 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.2 ptt-85 -59.91 -15.56 22.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.98 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -80.25 -35.0 36.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.756 0.312 . . . . 0.0 110.547 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.99 -44.64 91.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.762 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 14.5 p -71.84 -32.16 43.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.638 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -62.09 -50.7 70.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.678 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 11.2 p -72.03 -32.77 45.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.928 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.77 -45.61 70.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.92 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -67.91 -40.46 83.4 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.39 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -63.55 -24.42 67.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.623 179.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -108.0 79.5 0.91 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.432 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -64.6 -7.67 15.19 Favored 'Trans proline' 0 N--CA 1.494 1.528 0 C-N-CA 122.361 2.041 . . . . 0.0 112.584 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.5 tt -63.81 -42.52 97.67 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.159 179.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -82.53 -5.18 58.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.957 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -74.5 -35.12 63.21 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-O 120.823 0.344 . . . . 0.0 110.489 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.3 mt . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.292 179.957 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.774 0.321 . . . . 0.0 110.685 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 12.8 p30 -125.66 -40.41 2.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.892 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.2 t -53.52 152.1 5.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.929 0.395 . . . . 0.0 110.878 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.62 -19.72 64.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.356 -179.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 92.3 m -65.03 -37.16 86.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.82 0.343 . . . . 0.0 110.706 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.0 t -59.41 -45.56 91.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.655 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.78 -39.18 90.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.725 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 59.4 m -47.32 -43.58 22.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.385 -179.361 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -77.14 -26.91 53.65 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.804 -0.358 . . . . 0.0 111.043 -179.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.7 tpp85 -69.26 -50.11 50.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.761 0.315 . . . . 0.0 110.53 -179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.5 pp -70.59 -31.72 68.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.65 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.81 -48.81 77.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.533 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -66.88 -40.13 87.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.868 0.366 . . . . 0.0 110.535 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -62.37 -27.77 69.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.908 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -64.46 -61.89 1.94 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.872 0.368 . . . . 0.0 110.254 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.7 m -70.67 -18.51 21.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.367 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -82.18 -38.02 25.25 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.843 0.354 . . . . 0.0 110.889 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.88 19.13 18.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.203 -179.536 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.7 t -55.78 -49.35 73.39 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.129 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -50.58 -54.4 22.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.132 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -56.56 -45.83 81.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.629 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -53.55 -53.34 53.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.746 0.308 . . . . 0.0 111.124 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -67.38 -33.87 83.36 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.204 -0.758 . . . . 0.0 111.204 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.29 -42.88 99.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.735 0.302 . . . . 0.0 110.793 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.4 mt -66.09 -44.49 91.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.951 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.3 tp -65.27 -42.49 93.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.95 0.405 . . . . 0.0 110.12 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.8 m -58.89 -36.88 75.38 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.577 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 67.9 m -91.64 35.76 0.95 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.667 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.1 t -56.62 -17.73 9.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.038 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.1 p-10 -79.32 5.01 13.53 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.359 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.6 p -88.58 16.53 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.01 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 148.14 -27.69 1.4 Allowed Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 5.9 p -99.22 34.08 2.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.849 0.357 . . . . 0.0 110.44 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.8 p-10 -63.88 -10.72 22.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.383 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -90.7 28.05 1.62 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.782 0.325 . . . . 0.0 110.818 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 13.8 p90 -90.01 20.01 4.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.846 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -48.04 102.6 0.05 OUTLIER Glycine 0 CA--C 1.525 0.662 0 N-CA-C 111.141 -0.783 . . . . 0.0 111.141 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.9 mtmm -79.4 -20.12 48.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.718 0.294 . . . . 0.0 110.83 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.4 ptt-85 -58.73 -15.82 13.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.139 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -74.93 -24.97 58.58 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.765 0.317 . . . . 0.0 110.749 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.02 -44.47 87.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.073 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 1.6 p -77.31 -30.38 17.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.728 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -65.26 -46.34 80.92 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.791 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 13.6 p -71.67 -38.51 66.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 120.85 -0.34 . . . . 0.0 110.577 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -49.56 -54.71 16.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.791 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -64.3 -31.69 73.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.698 -179.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -62.71 -37.51 86.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.659 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -115.65 76.61 5.73 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.618 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -67.4 -13.03 37.92 Favored 'Trans proline' 0 C--N 1.308 -1.581 0 C-N-CA 122.7 2.267 . . . . 0.0 112.48 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 25.5 tp -58.81 -42.69 89.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.774 0.321 . . . . 0.0 110.402 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -50.7 -35.66 32.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.495 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 91.3 t80 -75.51 -47.91 24.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.69 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.7 mt . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.373 -179.975 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.847 0.356 . . . . 0.0 110.59 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -108.52 -37.78 5.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.603 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.8 t -49.88 150.96 1.99 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.342 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.14 -15.68 63.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.708 -179.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 95.5 m -69.34 -40.41 77.58 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.984 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 15.5 t -64.49 -49.25 72.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.831 -179.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.56 -40.76 96.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.916 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 9.1 m -48.91 -34.46 12.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.228 -179.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -80.44 -26.26 38.48 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.571 -179.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.8 -25.65 60.22 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.544 -0.462 . . . . 0.0 111.288 -179.196 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 pp -84.36 -26.38 28.46 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.567 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.39 -51.37 69.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.827 0.346 . . . . 0.0 110.486 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -64.29 -40.3 95.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.667 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -63.92 -36.71 84.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.646 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -56.1 -62.46 1.69 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.149 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 25.7 m -66.45 -19.21 25.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.311 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -84.98 -13.18 51.45 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.322 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.8 t -85.72 19.03 2.6 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 121.098 -0.241 . . . . 0.0 111.248 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.6 t -60.59 -37.37 81.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.961 0.41 . . . . 0.0 110.774 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.3 p-10 -81.79 -50.16 9.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.237 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 28.0 m120 -59.04 -44.24 91.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.109 -179.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -45.25 -56.31 4.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.484 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.27 -31.4 80.6 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 111.007 -0.837 . . . . 0.0 111.007 -179.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.27 -42.72 96.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.665 0.269 . . . . 0.0 110.674 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.6 mp -70.2 -44.07 78.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.69 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 62.9 tp -60.81 -50.55 73.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.277 0.561 . . . . 0.0 109.833 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 71.2 m -48.9 -29.21 4.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.638 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 56.3 m -90.97 36.0 0.91 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.75 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.8 t -56.27 -21.69 25.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.901 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.0 p-10 -83.2 9.83 9.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.313 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 6.6 p -84.93 -21.57 7.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.761 0.315 . . . . 0.0 110.677 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 129.4 22.69 1.18 Allowed Glycine 0 CA--C 1.528 0.85 0 N-CA-C 111.079 -0.809 . . . . 0.0 111.079 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 84.5 p -124.59 33.91 5.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.844 0.354 . . . . 0.0 110.417 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 48.9 p30 -92.13 26.84 2.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.759 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.7 m -91.3 27.61 1.88 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.836 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 35.5 p90 -126.07 25.65 6.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.629 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.1 123.92 12.21 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -65.92 -36.73 84.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.775 0.321 . . . . 0.0 110.701 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 7.1 ptp180 -63.1 -19.2 64.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.034 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -74.29 -29.79 61.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.802 0.334 . . . . 0.0 110.653 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.72 -41.48 86.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.032 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -71.91 -29.84 34.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.856 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -60.77 -52.2 66.09 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.606 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 10.3 p -70.17 -39.72 77.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.56 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.53 -46.3 70.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.91 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -66.82 -39.48 87.71 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.374 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -66.04 -24.79 66.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.505 179.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -105.83 85.48 1.55 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.509 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -63.68 -8.19 14.76 Favored 'Trans proline' 0 N--CA 1.495 1.573 0 C-N-CA 122.25 1.967 . . . . 0.0 112.67 -179.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.4 tt -59.28 -42.38 91.11 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.24 179.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -78.63 -10.43 59.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.008 179.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -74.43 -39.13 62.79 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.797 0.332 . . . . 0.0 110.543 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.3 mt . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.297 179.966 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.891 0.376 . . . . 0.0 110.739 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 48.2 p30 -113.01 23.89 12.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.837 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.6 t -130.7 154.11 48.27 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.458 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.04 -19.89 55.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.259 -179.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 98.1 m -63.21 -41.68 99.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.754 0.311 . . . . 0.0 110.896 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 44.1 t -60.35 -45.45 93.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.609 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.4 -40.62 97.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.729 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 84.8 m -45.79 -42.76 12.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.454 -179.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -82.1 -26.63 33.42 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.953 -179.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.5 tpp85 -66.97 -49.65 64.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.749 0.309 . . . . 0.0 110.708 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.6 pp -64.56 -32.64 74.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.499 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.66 -44.36 90.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.492 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -64.39 -40.79 96.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.937 0.399 . . . . 0.0 110.529 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -62.04 -33.68 74.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.903 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -58.88 -62.09 2.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.118 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 29.2 m -64.48 -18.42 23.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.357 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -86.44 -28.32 23.58 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.023 -179.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.2 t -96.49 19.21 12.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.244 -179.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 40.4 t -55.53 -56.72 17.03 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.283 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -49.15 -50.18 38.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.408 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 28.3 m120 -58.24 -43.6 87.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.738 179.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -53.79 -50.07 66.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.724 0.297 . . . . 0.0 110.94 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -64.79 -39.44 96.61 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.88 -43.17 98.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.743 0.306 . . . . 0.0 110.802 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 80.1 mt -69.34 -44.54 80.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.883 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 62.1 tp -61.0 -44.17 97.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.985 0.421 . . . . 0.0 110.181 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.5 m -53.48 -34.78 59.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.607 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.1 m -91.08 35.71 0.91 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.675 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.8 t -57.3 -17.49 12.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.006 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 33.4 p-10 -53.86 -22.15 9.19 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.697 0.284 . . . . 0.0 110.784 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 9.8 p -52.55 -24.1 5.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.68 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 130.58 26.89 0.77 Allowed Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 78.9 p -122.77 28.65 7.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.743 0.306 . . . . 0.0 110.499 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 -93.15 21.63 5.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.807 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.0 m -92.98 28.55 2.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.818 0.342 . . . . 0.0 110.566 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 19.7 p90 -122.33 24.61 9.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.623 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.1 119.2 5.85 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -70.72 -25.46 62.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.765 0.317 . . . . 0.0 110.666 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -67.11 -18.67 65.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.015 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.25 -25.48 55.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.811 0.339 . . . . 0.0 110.702 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.37 -39.89 88.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.969 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -78.18 -30.14 15.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.639 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -62.77 -49.91 73.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.712 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 8.8 p -66.82 -40.92 86.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.592 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -52.91 -51.89 59.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.96 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -63.57 -22.21 66.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.831 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -67.28 -34.79 78.16 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.78 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -123.98 75.05 57.92 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.67 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -68.49 -19.92 42.23 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 122.737 2.292 . . . . 0.0 112.3 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.4 tt -60.89 -42.83 98.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.596 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.15 -32.81 74.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.747 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -74.73 -41.46 60.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.788 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.9 mt . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.426 -179.771 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 11.9 m . . . . . 0 N--CA 1.47 0.532 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.2 p30 -105.7 30.63 5.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.598 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.5 t -143.09 147.79 35.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.751 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.6 -26.61 65.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.161 -179.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 95.1 m -58.01 -38.68 76.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.98 -179.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 48.3 t -59.82 -45.04 93.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.862 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.68 -44.4 93.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.651 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 96.9 m -56.06 -43.99 78.47 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.19 -179.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -73.94 -56.14 5.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.722 -179.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.43 -27.58 64.45 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.348 -179.225 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.3 tp -71.52 -47.94 52.05 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.814 -0.355 . . . . 0.0 110.462 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.88 -42.27 93.37 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.95 -179.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -63.91 -39.36 93.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.838 0.351 . . . . 0.0 110.949 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -71.88 -36.44 70.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.959 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -63.98 -59.44 4.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.55 -179.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 35.8 m -51.08 -22.99 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.396 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -94.75 -30.6 14.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.819 0.342 . . . . 0.0 110.896 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.4 t -99.31 19.51 15.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.192 -179.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.7 t -49.48 -50.38 41.59 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.778 0.323 . . . . 0.0 110.316 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 -46.93 -52.08 15.39 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.462 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.8 m-20 -56.98 -44.92 83.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.386 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -57.01 -45.69 82.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.823 0.344 . . . . 0.0 110.431 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -62.04 -49.69 72.82 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.41 -42.07 81.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.719 0.295 . . . . 0.0 110.908 -179.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 77.3 mt -63.87 -48.57 85.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.952 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.1 tp -62.97 -39.07 93.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.785 0.326 . . . . 0.0 110.555 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.2 t -49.58 -31.04 9.72 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.63 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 70.9 m -90.52 36.03 0.89 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.824 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.8 t -85.61 15.86 4.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.226 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -92.75 15.57 14.28 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.978 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.3 p -90.63 19.92 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 CA-C-O 120.785 0.326 . . . . 0.0 110.749 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 108.78 20.52 8.01 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 111.176 -0.769 . . . . 0.0 111.176 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 77.2 p -125.36 28.43 6.31 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.798 0.332 . . . . 0.0 110.479 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -94.37 22.07 6.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.855 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.4 m -93.65 26.26 3.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.627 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 20.1 p90 -118.8 22.43 11.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.803 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -48.94 108.0 0.36 Allowed Glycine 0 CA--C 1.525 0.66 0 N-CA-C 111.022 -0.831 . . . . 0.0 111.022 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -70.18 -27.25 64.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.79 0.329 . . . . 0.0 110.518 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -59.76 -18.69 45.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.933 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.98 -25.8 31.93 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.82 0.343 . . . . 0.0 110.583 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.41 -45.11 95.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.891 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 8.1 p -73.56 -30.61 30.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.6 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -64.26 -45.52 87.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.688 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 14.4 p -75.79 -31.73 23.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.722 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.58 -39.71 92.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.795 0.331 . . . . 0.0 110.626 179.768 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -62.2 -44.67 96.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.717 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -69.48 -38.47 77.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.648 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -76.1 157.31 83.41 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.449 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.46 -4.97 16.25 Favored 'Trans proline' 0 N--CA 1.493 1.492 0 C-N-CA 122.529 2.152 . . . . 0.0 112.692 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.5 tt -55.62 -42.43 74.9 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.862 0.363 . . . . 0.0 110.324 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 11.4 p-10 -77.75 -23.74 49.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.571 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -74.57 -35.4 63.03 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.689 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.2 mt . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.357 -179.951 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.796 0.331 . . . . 0.0 111.056 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -112.83 -36.12 5.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.017 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.4 t -45.92 145.28 1.53 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.965 0.412 . . . . 0.0 111.096 -179.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.94 -21.25 66.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.169 -179.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 95.9 m -69.5 -40.86 76.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.815 0.34 . . . . 0.0 110.742 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 20.4 t -61.57 -46.7 88.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.647 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.31 -36.55 84.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.818 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.5 m -47.77 -41.88 24.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.09 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -76.22 -26.57 56.2 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.765 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -71.61 -44.08 65.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.853 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.6 pp -78.61 -30.42 46.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.803 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.48 -49.98 75.39 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.264 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -63.9 -38.6 91.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.417 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -62.79 -34.72 77.86 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.822 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -57.84 -61.98 2.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.974 0.416 . . . . 0.0 110.107 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.2 m -67.6 -18.61 24.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.544 -179.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -87.61 -21.89 25.07 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.293 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.0 t -100.81 19.04 17.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.266 -179.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.2 t -62.36 -52.8 62.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.979 0.419 . . . . 0.0 110.618 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -54.41 -51.95 63.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.836 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -61.06 -42.88 99.31 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.767 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -48.9 -48.96 42.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.073 -179.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.4 -39.52 97.84 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 -179.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.36 -43.6 96.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.657 0.265 . . . . 0.0 111.1 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.3 mt -74.59 -43.72 47.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.031 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 65.7 tp -58.93 -48.59 80.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.934 0.397 . . . . 0.0 110.491 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.7 m -48.95 -27.32 3.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.719 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.9 m -90.76 36.12 0.9 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.695 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 6.3 t -86.37 45.64 1.26 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.732 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 48.1 p-10 -98.61 21.16 11.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.708 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -88.45 15.9 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.78 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 100.91 8.94 47.06 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 59.4 p -109.39 26.22 10.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.786 0.327 . . . . 0.0 110.514 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -92.5 24.5 3.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.652 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.46 23.48 3.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.715 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 21.6 p90 -106.9 18.78 21.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.596 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -52.16 142.4 23.22 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -61.77 -38.64 88.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.757 0.313 . . . . 0.0 110.599 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.0 ptt-85 -67.26 -16.09 64.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.057 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.93 -27.02 36.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.794 0.331 . . . . 0.0 110.617 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.3 -43.17 92.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.908 -179.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.2 p -75.48 -29.71 21.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.695 -179.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.5 tm-20 -63.58 -47.54 81.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.69 0.281 . . . . 0.0 110.842 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.6 p -72.75 -37.56 55.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.597 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.61 -51.82 65.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.92 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -69.3 -26.79 64.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.883 0.373 . . . . 0.0 110.557 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -67.66 -31.45 71.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.81 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -123.07 74.2 48.51 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.761 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -69.16 -8.23 23.02 Favored 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.821 2.347 . . . . 0.0 112.616 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.3 tt -64.73 -42.59 95.1 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.858 0.361 . . . . 0.0 110.443 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -57.74 -32.05 67.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.533 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -80.13 -43.78 21.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.788 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 32.9 mt . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.364 -179.963 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -73.62 153.21 49.01 Favored 'Trans proline' 0 N--CA 1.492 1.392 0 C-N-CA 122.319 2.013 . . . . 0.0 112.094 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.7 tp -69.04 140.05 19.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.542 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -65.07 141.92 58.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.563 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.3 p -72.26 161.41 30.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.506 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -94.94 21.97 7.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.784 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -82.44 132.49 35.21 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.593 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.4 p -134.2 142.9 39.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.544 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -141.05 70.91 1.35 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.591 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.33 165.68 0.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.601 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.14 164.61 30.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.665 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -59.23 153.05 19.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.723 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.5 m -67.71 80.44 0.19 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.823 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 25.2 p30 -111.49 -17.63 13.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.064 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 13.2 t -87.87 150.23 23.64 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.823 0.344 . . . . 0.0 110.67 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.57 -17.74 56.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.286 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 96.2 m -63.68 -39.24 93.82 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 121.007 -0.277 . . . . 0.0 110.742 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 51.3 t -58.64 -50.71 72.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.724 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.51 -39.87 92.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.646 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.9 m -46.34 -42.74 15.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.551 -179.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -82.65 -26.89 31.74 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.13 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.5 tpp85 -67.74 -44.79 76.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.716 0.293 . . . . 0.0 110.959 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.5 pp -69.8 -32.04 70.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.813 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.47 -45.32 88.87 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.933 -0.307 . . . . 0.0 110.655 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 29.5 m120 -65.95 -39.34 90.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.968 0.413 . . . . 0.0 110.542 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -63.99 -33.51 75.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.852 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -55.33 -62.19 1.83 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.905 0.383 . . . . 0.0 110.236 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 31.7 m -62.09 -18.26 19.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.378 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -86.72 -28.4 23.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.025 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.41 19.08 19.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.313 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.0 t -53.55 -51.69 62.11 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.491 -0.484 . . . . 0.0 110.187 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -49.75 -53.89 22.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.202 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -56.77 -43.08 80.47 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.84 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -58.14 -51.1 71.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.709 0.29 . . . . 0.0 111.377 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.83 -44.69 91.57 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 120.974 -0.631 . . . . 0.0 111.527 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.48 -40.98 96.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.739 0.305 . . . . 0.0 110.987 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.2 mt -70.09 -45.19 77.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.066 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 53.8 tp -64.79 -38.32 90.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.871 0.367 . . . . 0.0 110.471 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.6 m -55.07 -35.15 64.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.709 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 73.3 m -89.38 20.81 3.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.045 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.0 t -55.73 -21.72 20.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.807 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 45.0 p-10 -56.66 -18.04 10.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.974 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.0 p -53.4 -22.84 6.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.678 0.275 . . . . 0.0 110.807 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 148.52 -15.09 1.24 Allowed Glycine 0 CA--C 1.528 0.851 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 80.4 p -92.56 32.53 1.21 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.783 0.325 . . . . 0.0 110.593 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.2 p-10 -94.01 23.4 4.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.824 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.69 28.51 2.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.579 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 17.7 p90 -118.04 24.35 11.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.684 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -48.18 105.44 0.12 Allowed Glycine 0 CA--C 1.526 0.729 0 N-CA-C 111.061 -0.815 . . . . 0.0 111.061 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -70.58 -24.87 62.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.755 0.312 . . . . 0.0 110.724 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.4 ptt-85 -61.74 -18.4 59.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.904 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -67.54 -24.96 65.6 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.825 0.345 . . . . 0.0 110.608 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.18 -38.77 68.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.702 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.57 -30.62 17.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.492 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -63.59 -48.76 76.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.699 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 9.0 p -67.81 -39.82 82.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.572 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -48.2 -56.0 9.03 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.985 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -63.27 -32.15 73.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.961 0.41 . . . . 0.0 110.5 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -66.96 -29.23 69.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.625 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -122.95 74.63 48.05 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.701 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -68.0 -11.15 31.13 Favored 'Trans proline' 0 C--N 1.307 -1.632 0 C-N-CA 122.821 2.347 . . . . 0.0 112.549 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.9 tt -58.78 -42.49 89.14 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.743 0.306 . . . . 0.0 110.487 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 18.3 p-10 -52.13 -31.31 30.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.551 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 93.5 t80 -80.45 -47.84 13.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.698 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.5 mt -68.11 159.0 82.32 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.387 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -52.89 141.73 54.82 Favored 'Trans proline' 0 N--CA 1.494 1.532 0 C-N-CA 122.424 2.083 . . . . 0.0 112.07 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 87.4 mt . . . . . 0 C--O 1.221 -0.444 0 CA-C-O 118.028 -0.986 . . . . 0.0 110.536 179.934 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -69.61 154.74 67.93 Favored 'Trans proline' 0 C--N 1.309 -1.521 0 C-N-CA 122.442 2.095 . . . . 0.0 111.956 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 tp -50.16 133.16 9.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.566 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -70.36 152.45 44.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.513 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 82.6 p -70.8 168.14 17.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.588 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 33.4 p80 -90.5 22.55 3.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.825 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -66.21 141.65 57.98 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.576 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.9 p -126.75 140.2 49.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.568 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -143.59 67.76 1.29 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.551 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -58.11 153.87 13.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.57 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.28 173.71 11.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.665 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -71.44 142.89 50.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.515 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -53.39 95.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.055 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -114.34 -40.36 3.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.904 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 15.3 t -51.34 145.71 7.95 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.941 0.4 . . . . 0.0 110.552 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.93 -16.79 63.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.44 -179.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 93.4 m -68.18 -36.65 79.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.797 0.332 . . . . 0.0 110.663 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 45.5 t -59.95 -48.52 81.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.691 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.0 -33.87 74.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.609 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.8 m -62.08 -47.41 84.78 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.16 -179.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -74.3 -30.93 62.29 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.934 -0.307 . . . . 0.0 111.563 -179.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.32 -24.8 36.91 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.68 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.7 tp -75.36 -40.55 57.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.491 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.04 -50.06 74.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.802 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -63.96 -41.41 97.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.891 0.376 . . . . 0.0 110.796 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -67.61 -30.38 69.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.865 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -59.91 -62.14 2.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.927 0.394 . . . . 0.0 110.176 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 28.2 m -65.23 -21.85 30.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.245 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -84.51 -25.66 28.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.334 -179.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.8 t -100.47 18.97 17.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.257 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.3 t -60.31 -50.44 73.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.195 0.521 . . . . 0.0 110.258 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 14.5 p-10 -54.38 -48.74 71.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.437 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -62.55 -42.03 99.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.891 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -47.87 -50.07 27.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.654 0.264 . . . . 0.0 111.145 -179.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.38 -37.87 95.51 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.12 -44.05 97.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.616 0.245 . . . . 0.0 110.816 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.4 mt -71.8 -44.53 68.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.888 -0.325 . . . . 0.0 110.775 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 59.2 tp -59.37 -45.56 91.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.083 0.468 . . . . 0.0 110.024 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.6 m -51.86 -25.05 7.07 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.779 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 69.5 m -91.14 25.35 2.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.76 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 15.3 t -56.73 -21.46 28.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.838 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -80.58 7.68 9.5 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.405 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.3 p -89.98 20.02 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-O 120.815 0.34 . . . . 0.0 110.76 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 115.7 -15.19 17.07 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 111.327 -0.709 . . . . 0.0 111.327 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 80.3 p -102.18 33.58 3.03 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.762 0.315 . . . . 0.0 110.616 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.3 p-10 -91.39 22.71 3.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.784 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.9 m -93.41 28.34 2.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.591 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -99.43 18.65 17.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.954 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.5 108.9 0.51 Allowed Glycine 0 CA--C 1.525 0.689 0 N-CA-C 111.029 -0.828 . . . . 0.0 111.029 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -72.6 -25.74 61.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.829 0.347 . . . . 0.0 110.705 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 34.8 ptt-85 -65.53 -15.09 62.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.11 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -82.34 -32.39 29.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.788 0.327 . . . . 0.0 110.575 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.51 -44.26 89.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.978 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.8 p -72.78 -28.57 27.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.766 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -57.52 -46.78 83.42 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.686 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -68.91 -32.53 54.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.464 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.9 mp -54.77 -54.31 43.76 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.951 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -69.48 -28.13 65.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.935 0.398 . . . . 0.0 110.623 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -65.82 -37.01 85.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.888 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -119.07 75.2 14.33 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.666 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -71.15 -7.08 20.61 Favored 'Trans proline' 0 C--N 1.305 -1.711 0 C-N-CA 122.656 2.237 . . . . 0.0 112.522 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 tt -66.8 -42.88 85.23 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.787 0.327 . . . . 0.0 110.626 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -67.02 -30.82 71.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.593 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -76.5 -44.36 35.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.58 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 90.2 mt -72.42 158.94 86.62 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.296 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -51.92 139.72 50.12 Favored 'Trans proline' 0 N--CA 1.494 1.507 0 C-N-CA 122.372 2.048 . . . . 0.0 112.125 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.595 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.515 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -74.36 155.29 46.12 Favored 'Trans proline' 0 C--N 1.308 -1.574 0 C-N-CA 122.569 2.18 . . . . 0.0 112.175 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.4 tp -50.85 137.17 8.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.586 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 -64.01 157.31 25.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.611 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.1 p -71.04 164.6 25.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.522 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.6 p80 -89.6 20.27 4.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.841 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -62.94 135.17 57.16 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.787 0.327 . . . . 0.0 110.591 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.2 p -51.96 135.97 12.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.473 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -146.63 164.7 31.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.62 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -138.9 160.86 38.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.651 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.51 63.45 1.26 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.528 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.1 pttp -52.44 148.97 6.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.581 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.68 90.04 0.27 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.696 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -110.74 -32.38 6.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.72 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.4 t -47.96 145.14 3.15 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.939 0.399 . . . . 0.0 110.811 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.25 -21.97 66.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.204 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 92.8 m -70.85 -41.6 71.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.853 0.359 . . . . 0.0 110.746 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 50.9 t -62.08 -47.65 83.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.774 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.51 -36.07 81.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.915 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.5 m -49.44 -45.62 46.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.375 -179.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -69.38 -27.81 65.63 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.876 -0.329 . . . . 0.0 111.248 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.5 tpp85 -74.65 -52.51 11.48 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.735 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.6 pp -68.96 -33.92 74.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.649 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.04 -46.6 85.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.73 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 31.3 m-20 -64.13 -39.95 95.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.867 0.365 . . . . 0.0 110.74 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -62.44 -31.62 72.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.773 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -64.1 -61.91 1.96 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.272 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.4 m -63.6 -18.45 22.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.629 -179.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -92.71 -26.9 17.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.259 -179.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.3 t -104.87 19.3 20.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.168 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 44.6 t -58.14 -51.2 70.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.027 0.442 . . . . 0.0 110.486 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -52.03 -51.85 54.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.551 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -60.7 -42.03 96.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.647 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -53.06 -48.61 67.55 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.001 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.02 -38.22 96.24 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 -179.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.22 -44.14 97.75 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.685 0.279 . . . . 0.0 110.804 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.9 mt -72.23 -46.36 58.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.977 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 61.1 tp -58.25 -45.89 86.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.02 0.438 . . . . 0.0 110.261 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.8 m -49.47 -27.72 4.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.832 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 71.2 m -91.92 31.66 1.22 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.7 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.4 t -67.22 -8.92 35.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.267 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.2 p-10 -82.56 9.53 9.17 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 120.917 -0.313 . . . . 0.0 111.299 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 p -89.48 19.7 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-O 120.812 0.339 . . . . 0.0 110.776 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 115.56 -17.12 16.35 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 111.235 -0.746 . . . . 0.0 111.235 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 81.7 p -94.74 29.71 2.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.832 0.349 . . . . 0.0 110.569 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -92.81 23.6 4.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.738 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.7 m -92.82 28.5 2.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.581 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -119.24 25.12 10.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.646 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -48.58 114.09 1.84 Allowed Glycine 0 CA--C 1.526 0.73 0 N-CA-C 111.091 -0.804 . . . . 0.0 111.091 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -66.89 -33.73 76.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.775 0.322 . . . . 0.0 110.662 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.3 ptt-85 -61.31 -16.24 43.77 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.051 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -82.59 -25.34 33.32 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.824 0.345 . . . . 0.0 110.654 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.87 -42.51 93.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.805 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.3 p -77.8 -28.85 15.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.779 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -64.51 -45.98 84.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.661 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.0 p -73.61 -36.24 46.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.672 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -48.32 -49.92 32.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.043 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 40.3 mmtm -63.28 -40.32 97.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.921 0.391 . . . . 0.0 110.488 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -69.43 -21.96 63.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.791 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -114.92 74.59 3.53 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.626 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -67.52 -6.8 17.45 Favored 'Trans proline' 0 C--N 1.307 -1.625 0 C-N-CA 122.79 2.327 . . . . 0.0 112.473 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.4 tt -61.18 -42.15 98.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.729 0.3 . . . . 0.0 110.401 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 34.5 p-10 -54.67 -25.25 25.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.582 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -74.79 -47.56 30.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.505 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.0 mt -70.22 158.85 86.53 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.353 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -52.55 140.31 55.14 Favored 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 122.403 2.068 . . . . 0.0 112.11 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.22 -0.492 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.552 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -73.26 158.57 48.52 Favored 'Trans proline' 0 C--N 1.309 -1.551 0 C-N-CA 122.613 2.209 . . . . 0.0 112.186 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 tp -49.55 137.98 5.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.598 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -62.04 175.75 0.66 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.553 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 82.9 p -68.47 168.59 12.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.517 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.9 p80 -53.36 -25.65 16.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.586 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -65.24 133.13 50.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.531 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.1 p -134.6 141.92 41.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.601 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -148.36 158.67 44.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.528 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.9 pttm -71.82 128.4 35.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.641 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.47 63.24 1.27 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.491 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -88.34 139.98 29.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.632 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 49.1 m 31.84 81.74 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.538 0 O-C-N 124.136 0.898 . . . . 0.0 112.144 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.0 p30 -106.63 30.63 5.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.602 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.2 t -148.87 150.55 33.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.594 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.53 -21.4 64.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.068 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 98.4 m -58.96 -38.48 79.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.783 0.325 . . . . 0.0 110.675 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 47.7 t -58.51 -44.54 89.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.716 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.57 -39.65 91.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.685 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 98.8 m -59.63 -48.67 80.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.577 -179.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -75.28 -30.96 60.58 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.717 -178.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.17 -22.98 38.53 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.897 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 63.3 tp -74.41 -45.17 48.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.601 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.82 -44.53 86.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.977 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.73 -41.69 98.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.789 0.328 . . . . 0.0 110.804 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -66.98 -36.68 82.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.811 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -58.68 -62.01 2.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.331 -179.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.4 m -54.53 -19.48 3.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.482 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -97.19 -18.92 18.97 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.267 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.5 t -104.44 19.39 20.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.053 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 41.8 t -54.15 -51.96 62.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.865 0.364 . . . . 0.0 110.382 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 -48.9 -52.23 25.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.411 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.7 m120 -60.14 -41.83 93.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.522 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -56.92 -49.45 75.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.774 0.321 . . . . 0.0 110.715 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.36 -41.63 99.38 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.889 -0.885 . . . . 0.0 110.889 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.75 -44.18 97.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.706 0.289 . . . . 0.0 111.049 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 80.7 mt -70.82 -45.97 70.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.167 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 57.7 tp -61.48 -43.72 98.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.869 0.366 . . . . 0.0 110.556 -179.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.7 m -52.32 -24.37 7.42 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.859 -179.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 72.4 m -90.79 35.85 0.9 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.783 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.0 t -85.68 48.82 1.65 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.673 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.4 p-10 -78.49 0.8 24.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.176 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 10.0 p -65.08 -25.47 37.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 CA-C-O 120.824 0.345 . . . . 0.0 110.671 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 117.86 22.61 3.88 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 111.126 -0.79 . . . . 0.0 111.126 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 78.8 p -110.32 28.23 8.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.794 0.33 . . . . 0.0 110.563 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 48.9 p-10 -95.93 26.45 4.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.575 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.2 m -91.4 24.48 2.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.771 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 41.7 p90 -120.3 24.27 10.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.601 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -55.91 147.3 30.08 Favored Glycine 0 CA--C 1.525 0.656 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -62.81 -37.2 85.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.702 0.287 . . . . 0.0 110.591 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.1 ptt-85 -66.13 -18.26 65.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.006 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -73.66 -25.34 60.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.749 0.309 . . . . 0.0 110.579 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -57.69 -40.63 79.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.778 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -75.21 -30.67 23.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.608 -179.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -61.69 -49.01 78.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.724 0.297 . . . . 0.0 110.797 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 10.3 p -70.78 -39.99 76.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.603 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -48.46 -56.17 8.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.064 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -65.34 -33.91 77.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.974 0.416 . . . . 0.0 110.635 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -63.49 -35.24 79.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.822 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -114.19 75.17 3.05 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.789 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -68.02 -9.49 25.87 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 C-N-CA 122.752 2.301 . . . . 0.0 112.498 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.0 tt -60.23 -42.43 95.19 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.766 0.317 . . . . 0.0 110.394 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 24.0 p-10 -50.41 -29.9 11.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.484 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -74.69 -44.62 49.23 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.618 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.5 mt -70.22 158.82 86.59 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.288 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -53.2 141.67 58.28 Favored 'Trans proline' 0 N--CA 1.494 1.516 0 C-N-CA 122.353 2.035 . . . . 0.0 112.053 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.219 -0.511 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.505 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -74.18 153.46 46.13 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.555 2.17 . . . . 0.0 112.173 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 tp -54.29 141.32 10.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.581 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 22.8 pt-20 -59.03 139.62 56.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.653 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 95.7 p -86.6 160.94 18.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.66 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.8 p80 -65.05 -23.29 67.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.709 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -60.96 137.74 58.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.5 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 8.9 p -126.5 139.79 50.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.545 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -130.05 59.03 1.64 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.463 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 26.3 pttm -101.65 175.78 5.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.467 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.61 170.46 15.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.642 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.8 pttp -67.05 145.08 55.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.563 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.2 m -57.59 94.96 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.654 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -120.09 -36.49 3.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.755 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.6 t -67.24 145.46 55.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.697 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.13 -17.58 28.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.215 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 96.0 m -63.23 -38.71 92.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.739 0.304 . . . . 0.0 110.688 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 52.4 t -59.15 -50.17 75.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.601 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.16 -39.09 89.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.664 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 97.5 m -47.94 -46.11 31.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.358 -179.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -68.72 -28.24 66.65 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.838 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.3 tpp85 -72.22 -44.28 63.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.878 0.37 . . . . 0.0 110.535 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 62.6 tp -57.93 -46.7 84.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.637 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.98 -45.84 71.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.74 -179.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -68.19 -40.55 82.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.908 0.385 . . . . 0.0 110.564 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -64.91 -27.35 68.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.926 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -61.34 -61.7 2.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.376 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 32.8 m -69.4 -18.38 22.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.478 -179.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -80.63 -38.03 29.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.838 0.352 . . . . 0.0 110.74 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.9 t -94.67 18.82 10.88 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.237 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.7 t -58.84 -48.45 81.29 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.108 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -50.43 -56.4 11.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.074 179.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -56.74 -44.89 82.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.885 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -55.23 -54.5 42.59 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.705 0.288 . . . . 0.0 111.313 -179.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.69 -38.4 94.49 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 111.356 -0.697 . . . . 0.0 111.356 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.72 -40.7 95.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.807 0.337 . . . . 0.0 110.667 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.404 HG21 HD11 ' A' ' 37' ' ' ILE . 78.4 mt -68.2 -43.53 84.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.997 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 56.8 tp -65.42 -41.67 93.32 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.154 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.7 m -59.23 -35.22 73.26 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.501 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 52.5 m -91.56 35.39 0.95 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.673 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.9 t -56.72 -20.94 24.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.932 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 47.1 p-10 -56.21 -18.33 9.99 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.014 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.2 p -51.89 -25.18 5.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 120.731 0.301 . . . . 0.0 110.721 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 148.11 -14.48 1.3 Allowed Glycine 0 CA--C 1.528 0.864 0 N-CA-C 111.459 -0.656 . . . . 0.0 111.459 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 81.6 p -91.94 34.0 1.03 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.757 0.313 . . . . 0.0 110.68 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 44.7 p-10 -73.96 -0.81 17.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.375 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.5 m -92.13 28.12 1.98 Allowed 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.73 0.3 . . . . 0.0 110.606 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 13.0 p90 -98.53 19.27 14.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.924 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.59 102.64 0.06 OUTLIER Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm -80.18 -23.04 41.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.776 0.322 . . . . 0.0 110.661 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.1 ptt-85 -59.55 -19.01 45.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.946 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -62.61 -25.83 68.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.77 0.319 . . . . 0.0 110.608 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -54.73 -38.23 66.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.695 -179.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -76.83 -30.35 18.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.631 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -63.18 -51.01 68.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.665 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 9.2 p -65.62 -39.27 84.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.502 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -47.74 -56.03 8.26 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.812 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 40.5 mmtm -62.8 -35.34 79.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.935 0.398 . . . . 0.0 110.441 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.0 tmt_? -61.91 -37.49 84.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.601 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -110.66 76.11 1.11 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.509 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -64.57 -14.9 47.11 Favored 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.64 2.227 . . . . 0.0 112.409 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.2 tt -53.18 -41.41 65.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.425 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 30.2 p-10 -48.79 -29.97 5.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.582 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -74.72 -47.86 29.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.684 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.1 mt -60.57 158.84 28.13 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.396 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -53.01 141.68 56.18 Favored 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 122.377 2.051 . . . . 0.0 112.082 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 18.6 mt . . . . . 0 C--O 1.22 -0.483 0 CA-C-O 118.038 -0.982 . . . . 0.0 110.518 179.922 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.514 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -72.75 152.8 53.39 Favored 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.58 2.186 . . . . 0.0 112.132 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.0 tp -56.76 144.41 8.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.581 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -59.45 157.66 10.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.587 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 69.4 m -63.26 145.83 54.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.553 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -90.55 21.41 3.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.841 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -75.79 131.94 40.09 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.78 0.324 . . . . 0.0 110.524 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.6 p -52.67 139.86 9.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.532 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -145.58 168.22 21.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.657 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -138.98 155.91 47.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.552 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.24 63.34 1.28 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.096 0.474 . . . . 0.0 110.567 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -56.4 149.7 16.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.513 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -57.43 96.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.498 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -120.86 -36.52 3.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.699 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 13.3 t -61.2 145.28 51.72 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.538 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.54 -18.95 55.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.508 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 93.4 m -65.13 -39.83 93.6 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.782 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 52.3 t -63.3 -48.87 76.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.665 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.18 -39.07 91.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.609 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 89.9 m -48.63 -41.41 31.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.235 -179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -80.13 -26.4 39.45 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.123 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -70.93 -55.06 9.22 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.603 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.5 pp -61.01 -31.38 71.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.6 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.28 -41.58 89.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.71 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -62.83 -39.82 95.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.859 0.362 . . . . 0.0 110.625 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -65.01 -28.36 69.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.859 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -65.81 -61.78 1.87 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.73 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.2 m -68.52 -18.53 23.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.193 -179.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -85.48 -34.18 21.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.886 0.374 . . . . 0.0 110.526 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.6 t -96.39 19.05 12.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.161 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.1 t -57.99 -45.04 87.43 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.178 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -53.31 -55.14 27.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.117 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -57.48 -46.3 83.86 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.979 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -56.29 -54.74 41.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.692 0.282 . . . . 0.0 111.395 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.23 -35.97 92.26 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 111.246 -0.741 . . . . 0.0 111.246 -179.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.29 -40.52 96.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.801 0.334 . . . . 0.0 110.628 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 76.1 mt -68.85 -43.3 82.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.128 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 65.4 tp -67.55 -42.8 82.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.972 0.415 . . . . 0.0 110.296 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.0 m -62.05 -25.47 67.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.661 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.5 m -92.04 29.91 1.52 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.821 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.9 t -92.48 30.29 1.54 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.58 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 50.8 p-10 -89.93 20.98 3.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.931 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.7 p -88.7 17.8 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.818 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 144.49 -23.34 2.02 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.049 -0.82 . . . . 0.0 111.049 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 37.8 m -98.2 33.9 2.08 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.803 0.335 . . . . 0.0 110.548 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.0 p-10 -62.19 -12.9 22.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.19 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.2 m -91.43 28.49 1.68 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.75 0.309 . . . . 0.0 110.76 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.3 p90 -95.39 19.93 10.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.795 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -53.58 137.97 37.95 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -70.24 -25.07 63.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.748 0.308 . . . . 0.0 110.679 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -60.3 -20.34 58.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.906 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 35.7 t30 -64.15 -26.71 68.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.783 0.325 . . . . 0.0 110.659 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -52.84 -39.57 62.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.738 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.25 -29.72 17.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.426 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -62.06 -51.22 68.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.594 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 8.8 p -66.84 -40.37 85.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.82 0.343 . . . . 0.0 110.584 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.09 -56.06 12.4 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.838 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm -64.0 -27.81 69.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.807 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -64.46 -38.7 91.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.776 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -114.53 75.04 3.32 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.207 0.527 . . . . 0.0 110.388 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -68.48 -17.78 43.66 Favored 'Trans proline' 0 N--CA 1.495 1.577 0 C-N-CA 122.781 2.321 . . . . 0.0 112.553 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.2 tt -54.12 -42.69 69.75 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.775 0.322 . . . . 0.0 110.592 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -55.91 -33.52 64.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.519 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -74.83 -47.81 28.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.576 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.1 mt -70.9 159.51 85.22 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.414 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -52.88 140.17 58.64 Favored 'Trans proline' 0 N--CA 1.494 1.537 0 C-N-CA 122.456 2.104 . . . . 0.0 112.076 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.22 -0.478 0 CA-C-O 117.98 -1.009 . . . . 0.0 110.574 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.97 154.65 53.08 Favored 'Trans proline' 0 C--N 1.308 -1.555 0 C-N-CA 122.605 2.203 . . . . 0.0 112.126 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.5 tp -61.66 147.21 11.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.571 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -60.25 144.51 50.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.573 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.0 p -70.71 162.51 28.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.656 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.7 p80 -63.16 -23.08 67.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.732 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -54.37 135.11 45.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.578 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.3 p -134.74 144.16 35.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.583 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -140.06 175.83 9.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.614 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.84 162.25 32.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.616 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.2 150.55 36.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.564 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.8 pttp -67.71 142.86 56.17 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.879 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.63 85.28 2.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.697 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -102.6 -33.87 9.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.665 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.6 t -46.57 145.34 1.87 Allowed 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.985 -179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.85 -21.39 66.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.314 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 97.1 m -71.01 -40.36 71.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.895 0.379 . . . . 0.0 110.901 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 36.6 t -62.51 -47.61 83.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.683 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.65 -36.91 85.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.801 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.8 m -47.84 -45.39 29.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.35 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -70.19 -27.97 64.92 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.862 -0.335 . . . . 0.0 111.061 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -74.29 -56.43 4.89 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.788 -0.365 . . . . 0.0 110.713 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.5 pp -64.61 -30.65 71.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.621 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.27 -46.82 88.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.487 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -61.47 -41.2 96.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.708 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -64.52 -35.61 81.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.651 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -59.58 -53.42 58.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.118 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 32.6 m -71.06 -18.32 20.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.465 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -95.66 -12.41 25.6 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.562 -179.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.6 t -115.5 18.84 15.76 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 121.115 -0.234 . . . . 0.0 110.816 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.3 t -63.99 -46.61 83.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.265 0.555 . . . . 0.0 110.385 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -58.98 -59.13 5.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.88 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 28.1 m120 -59.68 -43.19 94.12 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.979 -179.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -52.6 -43.16 65.17 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.906 -0.317 . . . . 0.0 110.824 -179.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -59.87 -37.22 92.23 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.645 -0.982 . . . . 0.0 110.645 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.58 -43.5 93.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.721 0.296 . . . . 0.0 110.559 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 80.1 mt -69.31 -44.76 80.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.569 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 64.4 tp -55.98 -50.91 69.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.136 0.493 . . . . 0.0 109.884 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 68.9 m -47.44 -28.75 2.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.881 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 52.2 m -91.05 35.44 0.91 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.693 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.7 t -64.59 -11.25 32.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.16 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -82.1 9.08 9.2 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 120.979 -0.288 . . . . 0.0 111.283 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -89.45 19.22 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 120.954 -0.299 . . . . 0.0 110.812 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 119.23 -17.09 10.62 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 111.261 -0.736 . . . . 0.0 111.261 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 79.8 p -98.02 32.07 2.52 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.818 0.342 . . . . 0.0 110.61 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 49.6 p30 -95.24 25.44 4.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.732 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.64 28.55 1.98 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.518 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -112.71 21.31 15.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.865 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.32 132.02 25.34 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -71.06 -28.38 64.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.728 0.299 . . . . 0.0 110.608 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.4 ptt-85 -56.67 -18.36 12.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.951 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -72.14 -34.92 68.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.76 0.314 . . . . 0.0 110.551 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.88 -42.24 93.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.832 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.46 -29.91 48.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.485 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -71.26 -47.39 57.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.18 -179.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -73.39 -31.32 33.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.145 -179.322 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.7 mp -64.06 -42.64 96.94 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.923 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -67.42 -39.27 85.47 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.412 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -61.42 -25.19 67.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.533 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -107.11 80.6 0.84 Allowed Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.508 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -63.16 -9.17 16.29 Favored 'Trans proline' 0 N--CA 1.495 1.581 0 C-N-CA 122.371 2.048 . . . . 0.0 112.692 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.4 tt -58.65 -42.29 88.04 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.321 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 39.5 p-10 -75.51 -12.23 60.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.037 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -74.57 -37.11 63.05 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.857 0.36 . . . . 0.0 110.489 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.2 mt -71.3 158.97 86.94 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.31 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -52.43 139.2 56.07 Favored 'Trans proline' 0 N--CA 1.494 1.508 0 C-N-CA 122.4 2.066 . . . . 0.0 112.063 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.947 -1.025 . . . . 0.0 110.582 -179.971 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.525 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -73.74 158.2 47.16 Favored 'Trans proline' 0 C--N 1.308 -1.553 0 C-N-CA 122.55 2.167 . . . . 0.0 112.253 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 tp -49.07 116.71 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.526 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.0 pt-20 -51.93 169.17 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.573 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 68.9 m -67.84 142.93 55.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.559 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 35.2 p80 -69.14 -20.25 64.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.891 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -54.77 132.15 45.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.775 0.321 . . . . 0.0 110.485 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.0 p -130.94 141.19 46.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.639 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -132.64 69.25 1.48 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.419 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -62.58 177.26 0.54 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.625 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.82 163.61 32.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.499 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -62.91 136.89 58.09 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.886 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 20.2 t -69.14 79.04 0.34 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.695 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 47.2 p30 -87.46 -3.35 59.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.302 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.2 t -50.81 156.83 0.89 Allowed 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.835 0.35 . . . . 0.0 110.378 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.66 -34.89 65.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.87 -178.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 98.4 m -61.26 -50.21 73.97 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.947 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 60.6 m -68.08 -38.9 82.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.793 0.33 . . . . 0.0 110.564 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.17 -38.81 92.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.664 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.6 m -53.17 -47.39 68.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.462 -179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -78.98 -27.01 43.37 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.71 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -64.18 -51.45 63.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.546 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.3 pp -72.62 -25.65 61.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.807 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.15 -52.5 58.54 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.635 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -69.07 -36.63 77.85 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.71 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -60.59 -36.25 78.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.608 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -60.28 -51.7 68.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.021 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 27.7 m -76.04 -18.54 15.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.291 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -78.22 -41.64 33.76 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.756 0.313 . . . . 0.0 111.162 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.9 t -91.48 18.89 6.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.499 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.9 t -59.27 -50.31 74.49 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.323 -0.551 . . . . 0.0 109.964 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -48.95 -53.43 19.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.157 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -59.21 -44.73 92.26 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.606 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -51.81 -52.2 50.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.102 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -66.74 -35.63 90.02 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.347 -0.701 . . . . 0.0 111.347 -179.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.3 -41.25 98.94 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.704 0.288 . . . . 0.0 110.696 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.5 mt -72.42 -44.29 62.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.727 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 64.8 tp -60.62 -47.57 85.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.997 0.427 . . . . 0.0 110.226 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.4 t -50.04 -30.79 11.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.57 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.7 m -96.08 35.81 1.39 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.725 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.4 t -91.43 34.17 0.97 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.717 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -91.75 20.79 5.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.811 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 5.4 p -101.54 4.84 10.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.785 0.326 . . . . 0.0 110.803 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 93.01 19.3 36.93 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.11 -0.796 . . . . 0.0 111.11 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 77.8 p -109.73 32.58 4.94 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.772 0.32 . . . . 0.0 110.597 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 46.2 p-10 -99.92 26.23 6.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.702 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.76 23.92 9.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.756 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 8.9 p90 -133.12 22.58 4.12 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.652 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -60.22 145.99 46.13 Favored Glycine 0 CA--C 1.524 0.603 0 N-CA-C 110.977 -0.849 . . . . 0.0 110.977 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -64.09 -36.0 82.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.778 0.323 . . . . 0.0 110.623 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.5 ptt-85 -59.75 -20.36 56.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.725 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.37 -23.63 66.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.627 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.51 -38.84 72.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.795 -179.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -76.13 -32.61 23.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 120.819 -0.353 . . . . 0.0 110.444 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -64.63 -50.44 67.13 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.784 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.5 p -64.09 -42.53 95.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.62 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -47.94 -50.03 28.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.015 -179.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -61.28 -38.1 85.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.9 0.381 . . . . 0.0 110.522 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.8 tmt_? -65.65 -36.5 83.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.473 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -108.07 88.12 4.43 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.473 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -66.27 -5.65 13.04 Favored 'Trans proline' 0 N--CA 1.495 1.567 0 C-N-CA 122.144 1.896 . . . . 0.0 112.799 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.9 tp -60.94 -42.57 98.47 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.898 -0.321 . . . . 0.0 110.615 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -62.89 -17.34 61.53 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.937 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 55.8 t80 -74.56 -48.04 29.16 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.765 0.317 . . . . 0.0 110.321 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.1 mt -71.97 158.92 86.8 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.335 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -52.97 140.22 59.39 Favored 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 122.346 2.031 . . . . 0.0 112.052 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.539 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -73.82 165.87 31.13 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 122.514 2.143 . . . . 0.0 112.228 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.7 tp -60.08 144.58 12.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.63 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -71.23 168.84 16.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.513 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 82.7 p -67.7 162.61 23.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.585 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.5 p80 -91.15 23.15 3.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.768 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -65.92 135.82 55.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.583 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 7.0 p -137.77 146.55 27.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.516 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -143.45 162.24 36.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.603 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.5 pttt -135.24 149.95 49.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.498 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.18 178.62 7.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.641 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -80.75 148.6 30.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.51 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.57 92.79 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.697 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -114.02 -34.32 5.44 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.744 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -46.9 146.43 1.66 Allowed 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.083 -179.672 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.83 -20.96 66.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.05 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 97.8 m -69.43 -40.46 77.23 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.81 0.338 . . . . 0.0 110.733 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.6 t -60.59 -46.27 90.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.565 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.07 -29.35 69.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.803 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.5 m -61.49 -42.23 98.47 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.584 -179.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -74.52 -32.62 62.54 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.799 -178.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.84 -24.27 31.0 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.852 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 14.2 tp -77.86 -40.76 39.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.378 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.7 -45.69 91.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.795 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -63.81 -41.75 97.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.826 0.346 . . . . 0.0 110.624 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -71.2 -28.43 64.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.738 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -60.37 -62.08 2.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.08 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.3 m -67.8 -18.57 23.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.379 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -88.58 -21.24 24.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.121 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.1 t -109.91 18.83 19.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.104 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 44.1 t -63.16 -52.46 62.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.053 0.454 . . . . 0.0 110.415 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -54.12 -57.65 10.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.837 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 29.2 m120 -58.96 -42.02 88.88 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.663 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -52.65 -41.79 64.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.18 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.8 -40.67 99.13 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.62 -42.32 87.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.724 0.297 . . . . 0.0 110.611 -179.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.4 mt -70.45 -45.73 73.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.574 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 60.7 tp -55.45 -50.92 68.58 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.944 0.402 . . . . 0.0 110.278 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.5 m -56.89 -36.0 69.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.609 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 75.1 m -90.79 35.85 0.9 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.86 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.6 t -85.22 47.93 1.49 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.858 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 16.4 p-10 -92.41 23.42 3.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.696 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.8 p -88.28 17.72 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.934 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.15 20.35 72.88 Favored Glycine 0 CA--C 1.53 0.974 0 N-CA-C 111.471 -0.651 . . . . 0.0 111.471 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 78.0 p -109.05 31.2 5.88 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.846 0.355 . . . . 0.0 110.359 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 19.8 p-10 -95.79 27.07 3.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.583 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.1 m -68.44 -14.09 62.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.695 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -90.32 20.72 4.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.618 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.19 144.84 7.77 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -62.37 -38.43 89.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.742 0.306 . . . . 0.0 110.509 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 34.8 ptt-85 -62.34 -14.18 36.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.142 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.44 -32.09 42.66 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.541 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.04 -44.6 91.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.803 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -70.2 -29.12 38.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.591 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -65.9 -46.56 77.87 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 121.007 -0.277 . . . . 0.0 110.85 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.5 p -76.62 -33.83 22.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.742 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.18 -50.82 63.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.889 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -68.61 -38.97 81.01 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.694 -0.403 . . . . 0.0 110.513 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.5 tmt_? -66.37 -22.24 66.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.677 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -108.26 82.59 1.61 Allowed Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.567 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -66.34 -5.96 13.84 Favored 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.375 2.05 . . . . 0.0 112.546 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 61.8 tp -62.74 -42.58 99.73 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -84.52 -8.02 59.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.986 179.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -74.85 -28.59 60.74 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-O 120.879 0.371 . . . . 0.0 110.525 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.8 mt -85.59 158.85 56.55 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.177 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -52.9 140.18 58.77 Favored 'Trans proline' 0 N--CA 1.493 1.492 0 C-N-CA 122.357 2.038 . . . . 0.0 112.066 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 117.96 -1.019 . . . . 0.0 110.562 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.46 155.81 54.9 Favored 'Trans proline' 0 N--CA 1.492 1.422 0 C-N-CA 122.32 2.014 . . . . 0.0 112.095 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.7 tp -50.46 141.07 3.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.546 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.1 pt-20 -56.02 164.8 1.12 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.587 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.2 p -69.9 161.55 29.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.652 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 33.1 p80 -64.03 -22.22 66.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.881 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -55.96 132.67 50.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.848 0.356 . . . . 0.0 110.539 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.3 p -58.2 150.92 4.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.606 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -147.62 165.57 30.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.595 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.5 pttt -138.98 147.83 42.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.602 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.42 63.51 1.27 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.592 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -60.07 147.32 39.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.636 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -73.63 86.32 1.63 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.7 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -104.43 -49.41 3.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.794 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.4 t -45.27 154.78 0.15 Allowed 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.013 0.435 . . . . 0.0 111.315 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.53 -18.27 62.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.288 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 99.1 m -63.39 -42.12 98.8 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.762 0.315 . . . . 0.0 110.775 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.6 t -61.85 -44.98 95.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.598 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.51 -34.18 72.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.89 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 78.7 m -62.18 -44.33 96.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.514 -179.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -72.67 -32.49 65.85 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.611 -178.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.12 -23.55 30.66 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.851 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 53.8 tp -84.01 -42.08 16.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.639 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.0 -44.49 94.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.96 -179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.8 m120 -63.5 -38.64 91.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.874 0.369 . . . . 0.0 111.111 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -70.31 -38.7 75.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.078 -179.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -66.32 -51.09 60.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.787 -179.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.9 m -58.87 -21.72 19.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.247 -179.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -97.1 -24.67 15.64 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.939 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 73.2 m -95.03 18.82 11.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.171 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.9 t -59.91 -48.44 81.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.226 0.536 . . . . 0.0 109.786 179.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -50.89 -53.14 35.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.456 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -61.76 -40.08 93.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.029 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -51.55 -40.44 59.7 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.721 -0.391 . . . . 0.0 110.569 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -59.81 -40.1 96.25 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.51 -43.47 89.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.723 0.297 . . . . 0.0 110.549 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 79.2 mt -69.87 -43.41 79.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.529 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 63.2 tp -56.94 -47.0 81.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.008 0.433 . . . . 0.0 110.151 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.0 m -48.21 -31.71 6.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.84 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 71.1 m -93.6 35.21 1.13 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.849 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.0 t -92.26 34.8 1.02 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.657 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -90.78 22.64 3.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.767 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 p -89.53 19.81 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.785 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 103.63 -13.32 53.93 Favored Glycine 0 CA--C 1.529 0.955 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 88.3 p -91.72 24.5 3.1 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.735 0.302 . . . . 0.0 110.686 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -97.8 26.59 5.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.589 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.49 24.94 2.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.719 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 30.5 p90 -116.34 22.74 12.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.72 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -59.86 155.89 29.25 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -61.6 -36.1 79.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.805 0.336 . . . . 0.0 110.624 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.3 ptt-85 -59.44 -14.91 14.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.146 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.8 t30 -79.98 -32.96 39.81 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.726 0.298 . . . . 0.0 110.571 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -57.81 -47.3 83.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.791 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 14.7 p -69.99 -31.13 46.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.67 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -64.4 -46.81 81.65 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.649 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 13.2 p -76.69 -31.93 20.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.96 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -55.47 -48.63 74.23 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 121.005 -0.278 . . . . 0.0 110.901 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -65.7 -38.56 89.56 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.3 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -63.84 -23.17 67.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.723 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -108.07 80.43 1.07 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.731 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -66.05 -6.48 14.58 Favored 'Trans proline' 0 N--CA 1.494 1.548 0 C-N-CA 122.456 2.104 . . . . 0.0 112.556 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.6 tt -57.18 -41.66 79.7 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.308 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 31.8 p-10 -70.6 -19.12 62.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.725 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -74.57 -38.44 62.68 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.621 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.6 mt -71.65 159.07 86.56 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.39 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -53.98 141.62 67.11 Favored 'Trans proline' 0 N--CA 1.494 1.509 0 C-N-CA 122.396 2.064 . . . . 0.0 112.065 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 mt . . . . . 0 C--O 1.22 -0.45 0 CA-C-O 117.982 -1.009 . . . . 0.0 110.565 179.955 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.13 156.43 46.96 Favored 'Trans proline' 0 C--N 1.309 -1.525 0 C-N-CA 122.623 2.215 . . . . 0.0 112.243 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.1 tp -49.57 143.04 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.556 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 -114.86 174.0 6.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.588 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.3 p -69.59 161.61 29.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.56 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.6 p-80 -107.46 28.06 8.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.543 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -58.83 133.36 55.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.573 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.0 p -136.14 141.95 40.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.597 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.45 59.4 1.1 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.545 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -61.03 160.34 10.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.521 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.24 165.32 28.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.768 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.1 ptpp? -75.84 149.8 37.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.568 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.8 m -74.6 69.09 1.7 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.728 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 48.0 p30 -112.05 30.78 6.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.456 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.3 t -142.03 151.89 42.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.434 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.6 -20.83 58.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.148 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 95.8 m -62.0 -39.23 91.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.753 0.311 . . . . 0.0 110.826 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 50.8 t -59.37 -49.59 77.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.619 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.75 -43.36 96.68 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.731 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 79.6 m -47.6 -42.43 23.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.458 -179.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -82.94 -26.24 31.58 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.25 -28.08 53.5 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.529 -0.469 . . . . 0.0 111.543 -179.046 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.6 pp -84.65 -32.69 23.52 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.636 179.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.0 -47.71 84.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.968 -179.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -64.91 -40.25 94.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.822 0.344 . . . . 0.0 111.032 -179.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -65.09 -37.79 88.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.96 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -66.65 -57.77 6.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.577 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.1 m -54.18 -21.27 5.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.203 -179.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -97.08 -28.35 14.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.837 0.351 . . . . 0.0 110.855 -179.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.2 t -97.79 19.45 13.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.126 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 44.1 t -49.9 -48.8 51.36 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.919 0.39 . . . . 0.0 110.117 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -48.04 -51.62 23.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.346 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -59.5 -43.06 93.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.522 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -55.46 -44.11 76.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.853 0.358 . . . . 0.0 110.378 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -62.26 -40.65 99.28 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.734 -0.946 . . . . 0.0 110.734 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.62 -44.78 95.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.675 0.274 . . . . 0.0 110.961 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 82.0 mt -69.99 -46.98 71.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.963 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 49.4 tp -59.23 -45.1 92.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.007 0.432 . . . . 0.0 110.439 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 69.5 m -51.21 -25.63 5.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.859 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 68.4 m -91.53 33.09 1.02 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.745 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.7 t -91.98 34.11 1.03 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.646 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -92.73 24.89 3.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.702 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 5.4 p -91.41 23.83 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.954 0.407 . . . . 0.0 110.556 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 88.29 20.85 47.32 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 80.7 p -121.5 25.75 9.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.783 0.325 . . . . 0.0 110.556 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.6 p-10 -98.08 26.6 5.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.644 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -90.98 26.31 2.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.843 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 48.7 p90 -123.91 21.09 9.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.714 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -65.45 159.25 45.26 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -63.91 -28.03 69.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.845 0.355 . . . . 0.0 110.575 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 34.9 ptt-85 -62.39 -14.2 37.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.124 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -82.7 -30.76 28.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.733 0.302 . . . . 0.0 110.698 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.89 -43.77 91.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.914 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.7 p -75.05 -29.74 22.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.772 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -61.63 -49.59 75.95 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.805 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.1 p -71.45 -37.68 65.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.677 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -48.83 -51.43 29.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.975 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 40.3 mmtm -65.98 -38.21 87.97 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.594 -0.443 . . . . 0.0 110.484 -179.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -67.94 -22.62 65.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.841 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -107.33 82.31 1.2 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.724 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -65.48 -6.81 14.38 Favored 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.354 2.036 . . . . 0.0 112.579 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.0 tt -57.48 -42.41 82.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.796 0.332 . . . . 0.0 110.2 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 34.8 p-10 -74.22 -15.26 61.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.836 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -74.7 -29.56 61.24 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.746 0.308 . . . . 0.0 110.615 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.3 mt -70.89 158.7 87.51 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.274 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -52.96 140.1 59.58 Favored 'Trans proline' 0 N--CA 1.493 1.487 0 C-N-CA 122.363 2.042 . . . . 0.0 112.094 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.562 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -73.89 156.12 48.16 Favored 'Trans proline' 0 C--N 1.309 -1.516 0 C-N-CA 122.615 2.21 . . . . 0.0 112.24 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.3 tp -51.4 147.45 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.603 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -62.96 155.14 28.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.687 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 80.2 p -79.14 167.97 20.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.617 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 31.9 p80 -67.56 -22.84 65.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.824 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -61.22 135.38 57.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.653 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.6 p -137.36 144.11 32.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.539 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.25 72.94 1.39 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.607 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.05 164.21 0.89 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.609 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.13 170.76 15.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.553 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.4 pttp -65.59 139.56 58.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.613 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.86 88.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.605 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 16.9 p30 -108.05 -28.84 9.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.912 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.8 t -48.94 145.25 4.04 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.87 0.366 . . . . 0.0 110.669 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.73 -23.69 67.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.512 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 96.8 m -70.34 -43.88 69.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.796 0.332 . . . . 0.0 110.827 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 22.2 t -62.45 -44.35 96.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.458 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.13 -37.77 88.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.707 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 97.7 m -47.98 -43.45 29.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.199 -179.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -72.14 -26.63 62.18 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.825 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -73.52 -49.61 25.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.763 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.6 pp -73.05 -33.05 65.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.596 -179.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.26 -46.39 86.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.808 0.337 . . . . 0.0 110.368 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -60.7 -41.57 95.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.568 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -63.15 -38.65 92.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.736 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -54.65 -62.03 1.92 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.001 0.429 . . . . 0.0 110.048 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 27.8 m -63.62 -18.75 22.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.177 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -86.41 -19.46 29.64 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.024 -179.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.4 t -85.7 19.07 2.58 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.344 -179.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.1 t -61.95 -38.24 87.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.173 0.511 . . . . 0.0 110.523 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 7.7 p-10 -72.9 -51.87 16.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.454 -0.793 . . . . 0.0 111.171 -179.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -61.14 -44.3 97.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.993 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -46.07 -57.13 4.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.67 -179.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -64.37 -36.34 93.07 Favored Glycine 0 CA--C 1.526 0.732 0 C-N-CA 120.866 -0.683 . . . . 0.0 111.528 -179.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.89 -40.83 96.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.636 0.255 . . . . 0.0 110.874 -179.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.0 mt -74.17 -42.74 51.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.769 0.319 . . . . 0.0 110.71 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 65.4 tp -59.46 -50.42 74.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.143 0.497 . . . . 0.0 110.056 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.3 m -50.15 -26.9 5.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.786 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.9 m -92.16 29.49 1.63 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.732 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.2 t -59.25 -18.78 40.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.939 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 45.5 p-10 -82.11 8.89 9.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.308 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -89.02 18.42 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-O 120.717 0.294 . . . . 0.0 110.823 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 124.83 -20.45 6.79 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 111.139 -0.784 . . . . 0.0 111.139 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 70.0 p -98.48 34.12 2.09 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.81 0.338 . . . . 0.0 110.57 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -82.84 10.18 8.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.311 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.5 m -92.9 28.48 2.07 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.82 0.343 . . . . 0.0 110.516 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 12.2 p90 -101.87 19.87 17.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.904 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.92 126.61 22.39 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -71.06 -25.79 62.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.783 0.325 . . . . 0.0 110.615 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.3 ptt-85 -68.08 -19.31 64.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.001 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.91 -30.83 62.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.742 0.305 . . . . 0.0 110.691 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.34 -40.45 86.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.072 -179.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -71.9 -29.84 34.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.904 -179.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -61.13 -51.3 69.69 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.701 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 9.1 p -70.53 -41.81 78.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.495 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -50.11 -50.73 47.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.895 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm -69.3 -28.1 65.97 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.463 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -61.03 -25.82 67.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.591 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -119.04 75.78 14.53 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.531 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -66.37 -7.36 17.37 Favored 'Trans proline' 0 C--N 1.308 -1.588 0 C-N-CA 122.554 2.17 . . . . 0.0 112.494 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.3 tt -66.76 -36.94 83.62 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.271 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -84.73 -24.51 28.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.557 179.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 94.2 t80 -84.82 -24.9 28.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.691 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 64.4 mt -86.75 159.7 51.64 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.365 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -53.09 141.0 59.22 Favored 'Trans proline' 0 N--CA 1.494 1.537 0 C-N-CA 122.392 2.061 . . . . 0.0 112.081 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 15.5 mt . . . . . 0 C--O 1.22 -0.477 0 CA-C-O 117.941 -1.028 . . . . 0.0 110.592 179.992 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -74.44 154.04 45.11 Favored 'Trans proline' 0 C--N 1.308 -1.577 0 C-N-CA 122.588 2.192 . . . . 0.0 112.211 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.7 tp -58.23 135.87 22.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.511 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -65.79 160.19 23.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.588 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 68.1 m -64.46 149.49 48.41 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.543 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.3 p80 -62.15 -24.8 67.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.727 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 54.5 tt0 -97.48 130.87 44.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.575 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.5 p -135.52 141.64 41.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.575 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -149.83 70.05 1.04 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.695 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 63.6 pttt -139.04 155.5 47.91 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.598 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 95.4 mtm-85 -73.3 145.84 45.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.626 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -75.28 142.64 43.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.634 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 52.9 m 31.8 74.3 0.05 Allowed 'General case' 0 N--CA 1.47 0.568 0 O-C-N 124.163 0.915 . . . . 0.0 112.224 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -103.6 30.44 5.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.659 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.8 t -148.84 147.85 29.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.686 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.61 -20.62 34.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.124 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 97.7 m -59.4 -40.08 85.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.772 0.32 . . . . 0.0 110.704 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 54.0 t -59.22 -44.3 92.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.662 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.36 -41.94 97.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.614 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 98.7 m -59.95 -45.85 91.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.745 -179.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -78.85 -29.83 44.84 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.779 -178.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.12 -22.65 33.31 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.185 -179.633 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 52.3 tp -83.6 -41.89 17.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.799 0.333 . . . . 0.0 110.54 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.45 -43.64 93.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.867 -179.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -63.06 -39.21 94.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.812 0.339 . . . . 0.0 111.0 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -66.03 -39.55 90.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.138 -179.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -65.78 -52.16 53.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.772 -179.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.6 m -59.24 -21.74 20.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.186 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -96.01 -25.9 15.75 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.871 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.7 t -100.86 19.22 17.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.135 -179.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 41.7 t -53.21 -51.33 62.47 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.922 0.391 . . . . 0.0 110.114 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -47.93 -53.37 16.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.557 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -60.5 -40.76 92.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.661 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -55.88 -39.52 71.67 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.395 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -60.95 -40.9 99.06 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.52 -1.032 . . . . 0.0 110.52 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.78 -43.89 85.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.746 0.308 . . . . 0.0 110.746 -179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.8 mt -67.98 -43.98 85.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.731 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 60.7 tp -58.73 -48.65 80.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.893 0.377 . . . . 0.0 110.425 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 68.8 m -49.02 -32.12 8.79 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.747 -179.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.5 m -94.97 35.85 1.24 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.838 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.8 t -91.67 33.19 1.03 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.734 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.8 p-10 -86.87 14.62 6.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.06 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.1 p -64.76 -22.72 31.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.755 0.312 . . . . 0.0 110.766 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 148.53 -17.82 1.29 Allowed Glycine 0 CA--C 1.528 0.855 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 84.9 p -92.45 26.89 2.44 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.739 0.304 . . . . 0.0 110.542 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -92.3 25.81 2.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.598 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.12 28.41 1.89 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.689 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -117.34 23.93 11.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.695 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -55.43 145.7 31.09 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.009 -0.837 . . . . 0.0 111.009 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.2 mtmm -62.78 -37.88 88.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.77 0.319 . . . . 0.0 110.717 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.3 ptt-85 -62.88 -17.34 61.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.112 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -74.03 -28.79 61.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.804 0.335 . . . . 0.0 110.705 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.71 -41.45 86.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.931 -179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -73.04 -30.93 33.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.814 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -63.39 -50.75 68.65 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.643 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 9.9 p -68.94 -39.19 79.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.601 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.26 -51.34 62.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.068 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -69.61 -35.47 75.3 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.532 -179.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.8 tmt_? -61.78 -28.92 69.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.658 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -113.4 75.16 2.29 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.75 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -68.35 -5.96 16.32 Favored 'Trans proline' 0 C--N 1.307 -1.63 0 C-N-CA 122.703 2.269 . . . . 0.0 112.548 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.7 tt -62.36 -41.09 98.33 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.896 0.379 . . . . 0.0 110.267 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -63.8 -32.87 74.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.253 179.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -74.9 -38.47 61.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.689 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.7 mt -68.34 159.1 82.5 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.436 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -53.79 143.37 59.34 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 122.424 2.083 . . . . 0.0 112.18 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 13.3 mt . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 117.982 -1.009 . . . . 0.0 110.569 179.915 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -71.7 153.1 59.49 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 C-N-CA 122.246 1.964 . . . . 0.0 112.189 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.6 tp -57.96 140.72 15.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.592 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -61.36 158.97 13.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.552 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.6 p -69.95 159.42 33.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.589 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.2 p80 -103.04 23.37 12.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.686 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 -66.04 133.87 51.69 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.481 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.7 p -130.48 138.58 53.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.58 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.66 66.56 1.26 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.519 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.91 142.46 9.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.511 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.21 170.94 15.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.665 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -58.79 140.25 55.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.717 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.1 m -72.51 84.98 1.13 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.665 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -99.23 -44.13 6.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.638 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.9 t -47.15 153.17 0.48 Allowed 'General case' 0 C--O 1.231 0.113 0 CA-C-O 120.892 0.377 . . . . 0.0 110.991 -179.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.95 -15.15 62.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.468 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 98.3 m -68.29 -44.48 75.4 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.832 0.349 . . . . 0.0 110.687 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 10.2 t -63.38 -43.09 98.58 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.348 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.07 -36.31 82.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.85 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 64.5 m -49.12 -43.87 41.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.208 -179.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -73.47 -26.53 60.95 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.786 -0.366 . . . . 0.0 111.139 -179.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -75.83 -39.82 55.99 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.91 -0.316 . . . . 0.0 111.017 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.4 pp -84.01 -30.45 26.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.6 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.69 -47.67 84.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.475 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.3 m-20 -64.21 -40.39 95.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.725 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -64.34 -36.84 85.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.724 -179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -53.29 -61.82 2.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.182 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 27.1 m -64.42 -19.81 25.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.339 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -95.39 -0.3 52.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.655 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.9 t -118.2 16.22 14.04 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.137 -0.225 . . . . 0.0 110.872 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.9 t -64.51 -44.55 90.56 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.223 0.535 . . . . 0.0 110.41 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -58.66 -59.63 5.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.893 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -60.51 -42.19 95.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.987 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -50.16 -43.93 52.43 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.939 -0.304 . . . . 0.0 110.932 -179.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -60.81 -37.82 94.27 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.21 -42.14 90.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.587 -0.307 . . . . 0.0 110.514 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.6 mt -69.09 -42.1 81.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.499 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 63.1 tp -58.89 -52.23 66.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.092 0.472 . . . . 0.0 109.922 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.3 t -51.67 -26.2 8.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.546 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.2 m -91.98 28.6 1.8 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.643 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.7 t -85.94 46.98 1.38 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.809 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 -90.66 21.43 4.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.833 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 p -90.16 20.5 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.718 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 85.14 20.99 56.4 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 61.3 p -119.64 29.41 7.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.773 0.321 . . . . 0.0 110.547 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -96.08 26.89 3.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.556 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.8 m -91.98 28.45 1.84 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.678 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 41.2 p90 -113.98 22.64 13.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.708 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -64.6 160.44 40.8 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.049 -0.82 . . . . 0.0 111.049 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm -63.16 -31.43 72.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.822 0.344 . . . . 0.0 110.691 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.1 ptt-85 -57.96 -16.48 12.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.024 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -79.85 -26.62 40.32 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.688 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.73 -51.74 68.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.902 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 4.8 p -66.09 -30.29 49.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.563 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -64.67 -47.67 77.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.664 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.95 -29.56 15.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.994 -179.682 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.5 mp -59.67 -44.25 93.66 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.876 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -66.79 -38.86 87.36 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.273 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -63.78 -25.21 68.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.345 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -108.67 80.48 1.23 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.368 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -65.08 -7.11 14.42 Favored 'Trans proline' 0 N--CA 1.494 1.556 0 C-N-CA 122.457 2.105 . . . . 0.0 112.771 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.0 tt -58.37 -41.04 83.88 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.377 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 -71.34 -13.9 62.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.917 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -74.53 -34.4 63.0 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.884 0.373 . . . . 0.0 110.404 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.1 mt -73.15 159.01 86.13 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.382 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -53.05 139.33 61.83 Favored 'Trans proline' 0 N--CA 1.493 1.48 0 C-N-CA 122.386 2.057 . . . . 0.0 112.056 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 C--O 1.22 -0.494 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.559 179.95 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -73.48 160.74 43.9 Favored 'Trans proline' 0 C--N 1.309 -1.527 0 C-N-CA 122.633 2.222 . . . . 0.0 112.272 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.5 tp -49.31 135.82 6.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.608 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -70.6 168.87 15.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.705 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.0 p -71.92 171.08 12.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.508 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.3 p80 -51.04 -28.1 9.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.499 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 41.9 tt0 -70.9 131.1 43.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.408 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.7 p -136.96 141.64 39.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.626 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.6 61.34 1.51 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.38 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -56.29 152.11 11.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.675 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.9 177.77 8.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.5 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -126.1 155.3 41.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.603 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 49.0 m 32.11 79.86 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 O-C-N 124.094 0.871 . . . . 0.0 112.186 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 23.2 p30 -103.51 30.47 4.97 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.49 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 10.6 t -146.03 149.64 34.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.684 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.91 -22.09 65.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.211 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 97.4 m -60.29 -39.2 86.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.927 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 50.4 t -58.94 -48.28 82.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.764 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.63 -43.65 98.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.726 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.3 m -48.58 -42.86 35.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.305 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -82.95 -26.35 31.46 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -179.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.48 -27.79 61.58 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.616 -0.434 . . . . 0.0 111.55 -179.046 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.4 pp -84.51 -29.24 26.14 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.701 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.1 -50.27 74.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.67 -179.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -63.59 -42.52 98.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.919 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -62.13 -39.15 91.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.946 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -66.56 -61.53 1.93 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.546 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 24.3 m -55.46 -20.97 8.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.294 -179.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -97.13 -21.85 17.09 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.225 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.2 t -97.19 19.1 13.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.28 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 41.5 t -55.42 -53.05 61.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.035 0.445 . . . . 0.0 109.848 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -48.01 -51.23 24.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.44 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -61.3 -40.13 93.01 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.841 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -53.47 -39.05 64.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.777 0.322 . . . . 0.0 110.637 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.98 -43.87 96.78 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 110.569 -1.012 . . . . 0.0 110.569 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.34 -43.14 92.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.711 0.291 . . . . 0.0 110.818 -179.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.5 mt -66.56 -47.59 83.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.879 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 63.3 tp -58.97 -45.64 90.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.897 0.379 . . . . 0.0 110.51 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 71.1 m -49.52 -29.77 7.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.729 -179.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 68.5 m -94.06 34.13 1.28 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.739 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.5 t -92.6 31.18 1.39 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.617 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 43.3 p-10 -94.06 23.49 4.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.741 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 p -89.34 19.71 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.806 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 112.05 -18.61 23.69 Favored Glycine 0 CA--C 1.527 0.792 0 N-CA-C 111.192 -0.763 . . . . 0.0 111.192 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 87.3 p -92.06 24.9 3.06 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.809 0.337 . . . . 0.0 110.63 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 50.3 p-10 -96.58 26.89 4.14 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.652 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.4 m -87.94 19.51 3.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.068 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 12.9 p90 -116.71 22.44 12.69 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.799 0.333 . . . . 0.0 110.55 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -58.79 153.93 28.54 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -61.79 -36.23 80.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.792 0.329 . . . . 0.0 110.692 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.2 ptt-85 -59.91 -15.56 22.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.98 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -80.25 -35.0 36.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.756 0.312 . . . . 0.0 110.547 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.99 -44.64 91.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.762 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 14.5 p -71.84 -32.16 43.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.638 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -62.09 -50.7 70.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.678 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 11.2 p -72.03 -32.77 45.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.928 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.77 -45.61 70.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.92 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -67.91 -40.46 83.4 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.39 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -63.55 -24.42 67.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.623 179.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -108.0 79.5 0.91 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.432 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -64.6 -7.67 15.19 Favored 'Trans proline' 0 N--CA 1.494 1.528 0 C-N-CA 122.361 2.041 . . . . 0.0 112.584 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.5 tt -63.81 -42.52 97.67 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.159 179.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -82.53 -5.18 58.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.957 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -74.5 -35.12 63.21 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-O 120.823 0.344 . . . . 0.0 110.489 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.3 mt -88.49 159.18 47.53 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.292 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -53.49 140.43 64.39 Favored 'Trans proline' 0 N--CA 1.494 1.507 0 C-N-CA 122.319 2.013 . . . . 0.0 112.093 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.22 -0.463 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.588 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -74.09 155.25 47.48 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.612 2.208 . . . . 0.0 112.223 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.8 tp -52.51 136.82 12.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.531 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -68.77 156.9 37.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.595 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 82.8 p -69.87 159.69 33.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.53 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 31.7 p80 -109.63 22.27 15.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.777 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -71.56 132.08 44.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.542 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.4 p -78.12 133.84 29.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.645 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.11 65.63 1.15 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.494 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.08 160.02 1.1 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.632 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.93 149.33 35.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.542 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.6 pttp -72.78 145.44 47.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.906 -179.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.15 94.2 0.88 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.685 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 12.8 p30 -125.66 -40.41 2.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.892 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.2 t -53.52 152.1 5.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.929 0.395 . . . . 0.0 110.878 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.62 -19.72 64.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.356 -179.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 92.3 m -65.03 -37.16 86.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.82 0.343 . . . . 0.0 110.706 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.0 t -59.41 -45.56 91.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.655 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.78 -39.18 90.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.725 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 59.4 m -47.32 -43.58 22.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.385 -179.361 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -77.14 -26.91 53.65 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.804 -0.358 . . . . 0.0 111.043 -179.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.7 tpp85 -69.26 -50.11 50.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.761 0.315 . . . . 0.0 110.53 -179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.5 pp -70.59 -31.72 68.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.65 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.81 -48.81 77.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.533 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -66.88 -40.13 87.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.868 0.366 . . . . 0.0 110.535 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -62.37 -27.77 69.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.908 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -64.46 -61.89 1.94 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.872 0.368 . . . . 0.0 110.254 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.7 m -70.67 -18.51 21.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.367 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -82.18 -38.02 25.25 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.843 0.354 . . . . 0.0 110.889 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.88 19.13 18.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.203 -179.536 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.7 t -55.78 -49.35 73.39 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.129 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -50.58 -54.4 22.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.132 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -56.56 -45.83 81.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.629 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -53.55 -53.34 53.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.746 0.308 . . . . 0.0 111.124 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -67.38 -33.87 83.36 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.204 -0.758 . . . . 0.0 111.204 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.29 -42.88 99.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.735 0.302 . . . . 0.0 110.793 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.4 mt -66.09 -44.49 91.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.951 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.3 tp -65.27 -42.49 93.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.95 0.405 . . . . 0.0 110.12 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.8 m -58.89 -36.88 75.38 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.577 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 67.9 m -91.64 35.76 0.95 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.667 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.1 t -56.62 -17.73 9.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.038 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.1 p-10 -79.32 5.01 13.53 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.359 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.6 p -88.58 16.53 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.01 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 148.14 -27.69 1.4 Allowed Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 5.9 p -99.22 34.08 2.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.849 0.357 . . . . 0.0 110.44 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.8 p-10 -63.88 -10.72 22.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.383 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -90.7 28.05 1.62 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.782 0.325 . . . . 0.0 110.818 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 13.8 p90 -90.01 20.01 4.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.846 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -48.04 102.6 0.05 OUTLIER Glycine 0 CA--C 1.525 0.662 0 N-CA-C 111.141 -0.783 . . . . 0.0 111.141 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.9 mtmm -79.4 -20.12 48.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.718 0.294 . . . . 0.0 110.83 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.4 ptt-85 -58.73 -15.82 13.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.139 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -74.93 -24.97 58.58 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.765 0.317 . . . . 0.0 110.749 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.02 -44.47 87.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.073 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 1.6 p -77.31 -30.38 17.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.728 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -65.26 -46.34 80.92 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.791 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 13.6 p -71.67 -38.51 66.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 120.85 -0.34 . . . . 0.0 110.577 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -49.56 -54.71 16.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.791 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -64.3 -31.69 73.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.698 -179.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -62.71 -37.51 86.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.659 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -115.65 76.61 5.73 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.618 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -67.4 -13.03 37.92 Favored 'Trans proline' 0 C--N 1.308 -1.581 0 C-N-CA 122.7 2.267 . . . . 0.0 112.48 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 25.5 tp -58.81 -42.69 89.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.774 0.321 . . . . 0.0 110.402 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -50.7 -35.66 32.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.495 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 91.3 t80 -75.51 -47.91 24.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.69 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.7 mt -72.18 159.28 85.84 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.373 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -53.77 141.08 66.42 Favored 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.355 2.036 . . . . 0.0 112.041 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.221 -0.443 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.58 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -74.31 152.94 45.11 Favored 'Trans proline' 0 C--N 1.309 -1.539 0 C-N-CA 122.554 2.169 . . . . 0.0 112.196 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.8 tp -63.46 140.85 18.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.576 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -60.18 142.14 54.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.562 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.3 p -71.98 160.77 31.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.565 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 33.0 p80 -63.82 -24.13 67.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.672 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -67.77 139.22 56.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.619 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 8.7 p -128.09 142.04 44.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.567 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.92 77.33 1.62 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.571 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.13 165.87 10.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.376 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.02 168.43 19.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.691 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -60.78 145.6 49.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.77 -179.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -69.7 84.55 0.46 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.59 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -108.52 -37.78 5.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.603 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.8 t -49.88 150.96 1.99 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.342 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.14 -15.68 63.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.708 -179.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 95.5 m -69.34 -40.41 77.58 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.984 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 15.5 t -64.49 -49.25 72.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.831 -179.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.56 -40.76 96.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.916 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 9.1 m -48.91 -34.46 12.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.228 -179.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -80.44 -26.26 38.48 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.571 -179.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.8 -25.65 60.22 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.544 -0.462 . . . . 0.0 111.288 -179.196 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 pp -84.36 -26.38 28.46 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.567 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.39 -51.37 69.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.827 0.346 . . . . 0.0 110.486 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -64.29 -40.3 95.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.667 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -63.92 -36.71 84.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.646 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -56.1 -62.46 1.69 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.149 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 25.7 m -66.45 -19.21 25.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.311 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -84.98 -13.18 51.45 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.322 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.8 t -85.72 19.03 2.6 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 121.098 -0.241 . . . . 0.0 111.248 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.6 t -60.59 -37.37 81.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.961 0.41 . . . . 0.0 110.774 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.3 p-10 -81.79 -50.16 9.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.237 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 28.0 m120 -59.04 -44.24 91.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.109 -179.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -45.25 -56.31 4.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.484 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.27 -31.4 80.6 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 111.007 -0.837 . . . . 0.0 111.007 -179.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.27 -42.72 96.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.665 0.269 . . . . 0.0 110.674 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.6 mp -70.2 -44.07 78.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.69 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 62.9 tp -60.81 -50.55 73.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.277 0.561 . . . . 0.0 109.833 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 71.2 m -48.9 -29.21 4.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.638 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 56.3 m -90.97 36.0 0.91 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.75 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.8 t -56.27 -21.69 25.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.901 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.0 p-10 -83.2 9.83 9.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.313 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 6.6 p -84.93 -21.57 7.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.761 0.315 . . . . 0.0 110.677 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 129.4 22.69 1.18 Allowed Glycine 0 CA--C 1.528 0.85 0 N-CA-C 111.079 -0.809 . . . . 0.0 111.079 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 84.5 p -124.59 33.91 5.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.844 0.354 . . . . 0.0 110.417 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 48.9 p30 -92.13 26.84 2.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.759 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.7 m -91.3 27.61 1.88 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.836 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 35.5 p90 -126.07 25.65 6.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.629 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.1 123.92 12.21 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -65.92 -36.73 84.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.775 0.321 . . . . 0.0 110.701 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 7.1 ptp180 -63.1 -19.2 64.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.034 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -74.29 -29.79 61.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.802 0.334 . . . . 0.0 110.653 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.72 -41.48 86.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.032 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -71.91 -29.84 34.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.856 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -60.77 -52.2 66.09 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.606 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 10.3 p -70.17 -39.72 77.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.56 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.53 -46.3 70.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.91 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -66.82 -39.48 87.71 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.374 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -66.04 -24.79 66.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.505 179.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -105.83 85.48 1.55 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.509 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -63.68 -8.19 14.76 Favored 'Trans proline' 0 N--CA 1.495 1.573 0 C-N-CA 122.25 1.967 . . . . 0.0 112.67 -179.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.4 tt -59.28 -42.38 91.11 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.24 179.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -78.63 -10.43 59.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.008 179.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -74.43 -39.13 62.79 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.797 0.332 . . . . 0.0 110.543 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.3 mt -72.24 158.76 86.99 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.297 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -52.44 137.79 56.97 Favored 'Trans proline' 0 N--CA 1.494 1.503 0 C-N-CA 122.321 2.014 . . . . 0.0 112.036 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.9 mt . . . . . 0 C--O 1.22 -0.49 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.542 -179.987 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -74.28 153.34 45.53 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.542 2.161 . . . . 0.0 112.185 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.8 tp -64.37 141.12 18.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.546 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -59.97 144.17 49.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.633 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.1 p -72.07 163.39 27.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.642 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.1 p-80 -102.35 23.66 11.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.699 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 54.2 tt0 -88.37 132.68 34.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.534 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.0 p -130.09 142.87 42.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.528 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.94 68.78 1.3 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.555 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -54.89 156.2 3.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.511 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.28 166.6 25.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.605 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.0 ptpp? -61.46 151.54 32.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.725 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.5 m -74.62 69.01 1.71 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.739 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 48.2 p30 -113.01 23.89 12.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.837 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.6 t -130.7 154.11 48.27 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.458 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.04 -19.89 55.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.259 -179.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 98.1 m -63.21 -41.68 99.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.754 0.311 . . . . 0.0 110.896 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 44.1 t -60.35 -45.45 93.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.609 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.4 -40.62 97.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.729 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 84.8 m -45.79 -42.76 12.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.454 -179.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -82.1 -26.63 33.42 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.953 -179.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.5 tpp85 -66.97 -49.65 64.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.749 0.309 . . . . 0.0 110.708 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.6 pp -64.56 -32.64 74.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.499 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.66 -44.36 90.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.492 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -64.39 -40.79 96.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.937 0.399 . . . . 0.0 110.529 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -62.04 -33.68 74.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.903 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -58.88 -62.09 2.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.118 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 29.2 m -64.48 -18.42 23.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.357 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -86.44 -28.32 23.58 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.023 -179.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.2 t -96.49 19.21 12.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.244 -179.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 40.4 t -55.53 -56.72 17.03 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.283 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -49.15 -50.18 38.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.408 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 28.3 m120 -58.24 -43.6 87.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.738 179.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -53.79 -50.07 66.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.724 0.297 . . . . 0.0 110.94 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -64.79 -39.44 96.61 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.88 -43.17 98.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.743 0.306 . . . . 0.0 110.802 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 80.1 mt -69.34 -44.54 80.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.883 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 62.1 tp -61.0 -44.17 97.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.985 0.421 . . . . 0.0 110.181 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.5 m -53.48 -34.78 59.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.607 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.1 m -91.08 35.71 0.91 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.675 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.8 t -57.3 -17.49 12.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.006 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 33.4 p-10 -53.86 -22.15 9.19 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.697 0.284 . . . . 0.0 110.784 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 9.8 p -52.55 -24.1 5.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.68 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 130.58 26.89 0.77 Allowed Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 78.9 p -122.77 28.65 7.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.743 0.306 . . . . 0.0 110.499 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 -93.15 21.63 5.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.807 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.0 m -92.98 28.55 2.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.818 0.342 . . . . 0.0 110.566 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 19.7 p90 -122.33 24.61 9.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.623 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.1 119.2 5.85 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -70.72 -25.46 62.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.765 0.317 . . . . 0.0 110.666 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -67.11 -18.67 65.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.015 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.25 -25.48 55.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.811 0.339 . . . . 0.0 110.702 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.37 -39.89 88.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.969 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -78.18 -30.14 15.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.639 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -62.77 -49.91 73.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.712 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 8.8 p -66.82 -40.92 86.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.592 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -52.91 -51.89 59.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.96 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -63.57 -22.21 66.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.831 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -67.28 -34.79 78.16 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.78 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -123.98 75.05 57.92 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.67 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -68.49 -19.92 42.23 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 122.737 2.292 . . . . 0.0 112.3 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.4 tt -60.89 -42.83 98.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.596 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.15 -32.81 74.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.747 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -74.73 -41.46 60.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.788 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.9 mt -64.64 159.23 62.93 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.426 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -53.43 141.38 61.73 Favored 'Trans proline' 0 N--CA 1.494 1.515 0 C-N-CA 122.417 2.078 . . . . 0.0 112.052 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.22 -0.496 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.556 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -72.95 159.12 48.72 Favored 'Trans proline' 0 C--N 1.309 -1.547 0 C-N-CA 122.561 2.174 . . . . 0.0 112.244 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.8 tp -49.42 131.5 7.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.552 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -78.97 173.38 12.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.606 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 70.2 m -61.79 151.03 35.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.531 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.5 p80 -60.78 -25.39 66.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.632 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -89.68 88.41 7.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.56 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.0 p -139.56 146.05 25.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.512 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.05 157.82 45.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.685 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 26.1 pttm -139.16 159.75 41.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.573 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -119.34 133.15 55.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.451 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.1 pttp -64.96 138.66 58.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.54 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 11.9 m 32.07 80.05 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 O-C-N 124.082 0.864 . . . . 0.0 112.059 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.2 p30 -105.7 30.63 5.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.598 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.5 t -143.09 147.79 35.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.751 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.6 -26.61 65.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.161 -179.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 95.1 m -58.01 -38.68 76.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.98 -179.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 48.3 t -59.82 -45.04 93.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.862 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.68 -44.4 93.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.651 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 96.9 m -56.06 -43.99 78.47 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.19 -179.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -73.94 -56.14 5.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.722 -179.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.43 -27.58 64.45 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.348 -179.225 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.3 tp -71.52 -47.94 52.05 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.814 -0.355 . . . . 0.0 110.462 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.88 -42.27 93.37 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.95 -179.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -63.91 -39.36 93.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.838 0.351 . . . . 0.0 110.949 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -71.88 -36.44 70.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.959 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -63.98 -59.44 4.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.55 -179.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 35.8 m -51.08 -22.99 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.396 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -94.75 -30.6 14.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.819 0.342 . . . . 0.0 110.896 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.4 t -99.31 19.51 15.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.192 -179.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.7 t -49.48 -50.38 41.59 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.778 0.323 . . . . 0.0 110.316 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 -46.93 -52.08 15.39 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.462 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.8 m-20 -56.98 -44.92 83.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.386 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -57.01 -45.69 82.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.823 0.344 . . . . 0.0 110.431 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -62.04 -49.69 72.82 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.41 -42.07 81.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.719 0.295 . . . . 0.0 110.908 -179.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 77.3 mt -63.87 -48.57 85.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.952 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.1 tp -62.97 -39.07 93.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.785 0.326 . . . . 0.0 110.555 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.2 t -49.58 -31.04 9.72 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.63 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 70.9 m -90.52 36.03 0.89 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.824 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.8 t -85.61 15.86 4.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.226 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -92.75 15.57 14.28 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.978 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.3 p -90.63 19.92 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 CA-C-O 120.785 0.326 . . . . 0.0 110.749 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 108.78 20.52 8.01 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 111.176 -0.769 . . . . 0.0 111.176 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 77.2 p -125.36 28.43 6.31 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.798 0.332 . . . . 0.0 110.479 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -94.37 22.07 6.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.855 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.4 m -93.65 26.26 3.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.627 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 20.1 p90 -118.8 22.43 11.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.803 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -48.94 108.0 0.36 Allowed Glycine 0 CA--C 1.525 0.66 0 N-CA-C 111.022 -0.831 . . . . 0.0 111.022 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -70.18 -27.25 64.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.79 0.329 . . . . 0.0 110.518 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -59.76 -18.69 45.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.933 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.98 -25.8 31.93 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.82 0.343 . . . . 0.0 110.583 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.41 -45.11 95.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.891 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 8.1 p -73.56 -30.61 30.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.6 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -64.26 -45.52 87.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.688 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 14.4 p -75.79 -31.73 23.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.722 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.58 -39.71 92.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.795 0.331 . . . . 0.0 110.626 179.768 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -62.2 -44.67 96.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.717 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -69.48 -38.47 77.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.648 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -76.1 157.31 83.41 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.449 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.46 -4.97 16.25 Favored 'Trans proline' 0 N--CA 1.493 1.492 0 C-N-CA 122.529 2.152 . . . . 0.0 112.692 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.5 tt -55.62 -42.43 74.9 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.862 0.363 . . . . 0.0 110.324 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 11.4 p-10 -77.75 -23.74 49.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.571 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -74.57 -35.4 63.03 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.689 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.2 mt -73.89 159.03 85.16 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.357 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -53.34 140.43 62.82 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 122.367 2.044 . . . . 0.0 112.053 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.22 -0.462 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.56 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -72.78 159.03 49.34 Favored 'Trans proline' 0 C--N 1.308 -1.58 0 C-N-CA 122.55 2.167 . . . . 0.0 112.153 -179.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.5 tp -49.58 140.29 3.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.548 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.0 pt-20 -57.04 175.64 0.13 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.655 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 66.4 m -63.31 162.78 11.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.601 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 17.5 p80 -68.61 -13.82 62.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.006 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.01 132.85 53.39 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.775 0.321 . . . . 0.0 110.363 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.2 p -122.78 146.22 28.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.659 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -147.14 162.25 39.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.539 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.2 pttt -130.61 152.03 50.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.584 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.27 163.43 34.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.521 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.6 ptpp? -82.5 134.37 35.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.541 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -53.27 95.15 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.056 -179.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -112.83 -36.12 5.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.017 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.4 t -45.92 145.28 1.53 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.965 0.412 . . . . 0.0 111.096 -179.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.94 -21.25 66.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.169 -179.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 95.9 m -69.5 -40.86 76.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.815 0.34 . . . . 0.0 110.742 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 20.4 t -61.57 -46.7 88.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.647 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.31 -36.55 84.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.818 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.5 m -47.77 -41.88 24.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.09 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -76.22 -26.57 56.2 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.765 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -71.61 -44.08 65.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.853 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.6 pp -78.61 -30.42 46.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.803 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.48 -49.98 75.39 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.264 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -63.9 -38.6 91.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.417 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -62.79 -34.72 77.86 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.822 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -57.84 -61.98 2.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.974 0.416 . . . . 0.0 110.107 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.2 m -67.6 -18.61 24.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.544 -179.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -87.61 -21.89 25.07 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.293 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.0 t -100.81 19.04 17.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.266 -179.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.2 t -62.36 -52.8 62.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.979 0.419 . . . . 0.0 110.618 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -54.41 -51.95 63.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.836 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -61.06 -42.88 99.31 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.767 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -48.9 -48.96 42.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.073 -179.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.4 -39.52 97.84 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 -179.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.36 -43.6 96.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.657 0.265 . . . . 0.0 111.1 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.3 mt -74.59 -43.72 47.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.031 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 65.7 tp -58.93 -48.59 80.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.934 0.397 . . . . 0.0 110.491 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.7 m -48.95 -27.32 3.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.719 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.9 m -90.76 36.12 0.9 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.695 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 6.3 t -86.37 45.64 1.26 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.732 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 48.1 p-10 -98.61 21.16 11.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.708 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -88.45 15.9 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.78 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 100.91 8.94 47.06 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 59.4 p -109.39 26.22 10.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.786 0.327 . . . . 0.0 110.514 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -92.5 24.5 3.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.652 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.46 23.48 3.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.715 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 21.6 p90 -106.9 18.78 21.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.596 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -52.16 142.4 23.22 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -61.77 -38.64 88.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.757 0.313 . . . . 0.0 110.599 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.0 ptt-85 -67.26 -16.09 64.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.057 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.93 -27.02 36.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.794 0.331 . . . . 0.0 110.617 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.3 -43.17 92.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.908 -179.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.2 p -75.48 -29.71 21.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.695 -179.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.5 tm-20 -63.58 -47.54 81.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.69 0.281 . . . . 0.0 110.842 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.6 p -72.75 -37.56 55.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.597 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.61 -51.82 65.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.92 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -69.3 -26.79 64.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.883 0.373 . . . . 0.0 110.557 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -67.66 -31.45 71.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.81 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -123.07 74.2 48.51 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.761 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -69.16 -8.23 23.02 Favored 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.821 2.347 . . . . 0.0 112.616 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.3 tt -64.73 -42.59 95.1 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.858 0.361 . . . . 0.0 110.443 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -57.74 -32.05 67.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.533 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -80.13 -43.78 21.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.788 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 32.9 mt -72.43 159.04 86.41 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.364 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -52.72 139.22 58.88 Favored 'Trans proline' 0 N--CA 1.493 1.484 0 C-N-CA 122.399 2.066 . . . . 0.0 112.121 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.22 -0.46 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.548 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.856 0.36 . . . . 0.0 110.823 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 25.2 p30 -111.49 -17.63 13.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.064 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 13.2 t -87.87 150.23 23.64 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.823 0.344 . . . . 0.0 110.67 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.57 -17.74 56.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.286 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 96.2 m -63.68 -39.24 93.82 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 121.007 -0.277 . . . . 0.0 110.742 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 51.3 t -58.64 -50.71 72.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.724 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.51 -39.87 92.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.646 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.427 ' HA ' HD21 ' A' ' 23' ' ' LEU . 94.9 m -46.34 -42.74 15.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.551 -179.306 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -82.65 -26.89 31.74 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.13 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.5 tpp85 -67.74 -44.79 76.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.716 0.293 . . . . 0.0 110.959 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.427 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.5 pp -69.8 -32.04 70.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.813 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.47 -45.32 88.87 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.933 -0.307 . . . . 0.0 110.655 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 29.5 m120 -65.95 -39.34 90.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.968 0.413 . . . . 0.0 110.542 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -63.99 -33.51 75.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.852 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.549 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -55.33 -62.19 1.83 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.905 0.383 . . . . 0.0 110.236 -179.714 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.549 ' N ' HD13 ' A' ' 27' ' ' LEU . 31.7 m -62.09 -18.26 19.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.378 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -86.72 -28.4 23.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.025 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.41 19.08 19.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.313 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.0 t -53.55 -51.69 62.11 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.491 -0.484 . . . . 0.0 110.187 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -49.75 -53.89 22.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.202 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -56.77 -43.08 80.47 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.84 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -58.14 -51.1 71.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.709 0.29 . . . . 0.0 111.377 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.83 -44.69 91.57 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 120.974 -0.631 . . . . 0.0 111.527 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.48 -40.98 96.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.739 0.305 . . . . 0.0 110.987 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.2 mt -70.09 -45.19 77.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.066 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.41 HD11 ' CZ ' ' A' ' 48' ' ' TYR . 53.8 tp -64.79 -38.32 90.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.871 0.367 . . . . 0.0 110.471 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.6 m -55.07 -35.15 64.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.709 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 73.3 m -89.38 20.81 3.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.045 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.0 t -55.73 -21.72 20.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.807 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 45.0 p-10 -56.66 -18.04 10.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.974 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.0 p -53.4 -22.84 6.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.678 0.275 . . . . 0.0 110.807 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 148.52 -15.09 1.24 Allowed Glycine 0 CA--C 1.528 0.851 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 80.4 p -92.56 32.53 1.21 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.783 0.325 . . . . 0.0 110.593 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.2 p-10 -94.01 23.4 4.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.824 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.69 28.51 2.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.579 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.41 ' CZ ' HD11 ' A' ' 38' ' ' LEU . 17.7 p90 -118.04 24.35 11.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.684 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -48.18 105.44 0.12 Allowed Glycine 0 CA--C 1.526 0.729 0 N-CA-C 111.061 -0.815 . . . . 0.0 111.061 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -70.58 -24.87 62.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.755 0.312 . . . . 0.0 110.724 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.4 ptt-85 -61.74 -18.4 59.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.904 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -67.54 -24.96 65.6 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.825 0.345 . . . . 0.0 110.608 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.457 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -55.18 -38.77 68.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.702 -179.718 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.57 -30.62 17.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.492 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -63.59 -48.76 76.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.699 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.412 HG13 ' N ' ' A' ' 57' ' ' LEU . 9.0 p -67.81 -39.82 82.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.572 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.457 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -48.2 -56.0 9.03 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.985 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -63.27 -32.15 73.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.961 0.41 . . . . 0.0 110.5 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -66.96 -29.23 69.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.625 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -122.95 74.63 48.05 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.701 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -68.0 -11.15 31.13 Favored 'Trans proline' 0 C--N 1.307 -1.632 0 C-N-CA 122.821 2.347 . . . . 0.0 112.549 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.9 tt -58.78 -42.49 89.14 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.743 0.306 . . . . 0.0 110.487 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 18.3 p-10 -52.13 -31.31 30.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.551 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 93.5 t80 -80.45 -47.84 13.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.698 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.5 mt . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.387 -179.819 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.527 0.083 0 CA-C-O 120.753 0.311 . . . . 0.0 111.055 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -114.34 -40.36 3.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.904 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.463 HG23 ' H ' ' A' ' 18' ' ' CYS . 15.3 t -51.34 145.71 7.95 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.941 0.4 . . . . 0.0 110.552 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.93 -16.79 63.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.44 -179.538 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 93.4 m -68.18 -36.65 79.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.797 0.332 . . . . 0.0 110.663 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.463 ' H ' HG23 ' A' ' 15' ' ' THR . 45.5 t -59.95 -48.52 81.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.691 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.0 -33.87 74.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.609 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.8 m -62.08 -47.41 84.78 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.16 -179.461 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -74.3 -30.93 62.29 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.934 -0.307 . . . . 0.0 111.563 -179.073 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.32 -24.8 36.91 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.68 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.7 tp -75.36 -40.55 57.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.491 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.04 -50.06 74.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.802 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -63.96 -41.41 97.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.891 0.376 . . . . 0.0 110.796 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -67.61 -30.38 69.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.865 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.549 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -59.91 -62.14 2.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.927 0.394 . . . . 0.0 110.176 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.549 ' N ' HD13 ' A' ' 27' ' ' LEU . 28.2 m -65.23 -21.85 30.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.245 -179.617 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -84.51 -25.66 28.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.334 -179.281 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.8 t -100.47 18.97 17.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.257 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.3 t -60.31 -50.44 73.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.195 0.521 . . . . 0.0 110.258 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 14.5 p-10 -54.38 -48.74 71.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.437 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -62.55 -42.03 99.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.891 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -47.87 -50.07 27.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.654 0.264 . . . . 0.0 111.145 -179.383 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.38 -37.87 95.51 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.12 -44.05 97.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.616 0.245 . . . . 0.0 110.816 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.4 mt -71.8 -44.53 68.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.888 -0.325 . . . . 0.0 110.775 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 59.2 tp -59.37 -45.56 91.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.083 0.468 . . . . 0.0 110.024 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.6 m -51.86 -25.05 7.07 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.779 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.442 ' O ' HG12 ' A' ' 43' ' ' VAL . 69.5 m -91.14 25.35 2.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.76 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 15.3 t -56.73 -21.46 28.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.838 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -80.58 7.68 9.5 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.405 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.442 HG12 ' O ' ' A' ' 40' ' ' SER . 4.3 p -89.98 20.02 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-O 120.815 0.34 . . . . 0.0 110.76 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 115.7 -15.19 17.07 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 111.327 -0.709 . . . . 0.0 111.327 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 80.3 p -102.18 33.58 3.03 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.762 0.315 . . . . 0.0 110.616 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.3 p-10 -91.39 22.71 3.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.784 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.9 m -93.41 28.34 2.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.591 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -99.43 18.65 17.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.954 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.5 108.9 0.51 Allowed Glycine 0 CA--C 1.525 0.689 0 N-CA-C 111.029 -0.828 . . . . 0.0 111.029 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -72.6 -25.74 61.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.829 0.347 . . . . 0.0 110.705 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 34.8 ptt-85 -65.53 -15.09 62.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.11 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -82.34 -32.39 29.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.788 0.327 . . . . 0.0 110.575 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.51 -44.26 89.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.978 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.8 p -72.78 -28.57 27.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.766 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -57.52 -46.78 83.42 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.686 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -68.91 -32.53 54.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.464 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.9 mp -54.77 -54.31 43.76 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.951 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -69.48 -28.13 65.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.935 0.398 . . . . 0.0 110.623 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -65.82 -37.01 85.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.888 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -119.07 75.2 14.33 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.666 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -71.15 -7.08 20.61 Favored 'Trans proline' 0 C--N 1.305 -1.711 0 C-N-CA 122.656 2.237 . . . . 0.0 112.522 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 tt -66.8 -42.88 85.23 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.787 0.327 . . . . 0.0 110.626 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -67.02 -30.82 71.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.593 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -76.5 -44.36 35.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.58 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 90.2 mt . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.296 179.9 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.936 0.398 . . . . 0.0 110.696 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -110.74 -32.38 6.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.72 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.526 HG23 ' H ' ' A' ' 18' ' ' CYS . 2.4 t -47.96 145.14 3.15 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.939 0.399 . . . . 0.0 110.811 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.25 -21.97 66.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.204 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 92.8 m -70.85 -41.6 71.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.853 0.359 . . . . 0.0 110.746 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.526 ' H ' HG23 ' A' ' 15' ' ' THR . 50.9 t -62.08 -47.65 83.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.774 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.51 -36.07 81.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.915 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.43 ' HA ' HD21 ' A' ' 23' ' ' LEU . 91.5 m -49.44 -45.62 46.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.375 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -69.38 -27.81 65.63 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.876 -0.329 . . . . 0.0 111.248 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.5 tpp85 -74.65 -52.51 11.48 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.735 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.43 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.6 pp -68.96 -33.92 74.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.649 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.04 -46.6 85.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.73 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 31.3 m-20 -64.13 -39.95 95.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.867 0.365 . . . . 0.0 110.74 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -62.44 -31.62 72.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.773 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.532 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -64.1 -61.91 1.96 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.272 -179.8 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.532 ' N ' HD13 ' A' ' 27' ' ' LEU . 33.4 m -63.6 -18.45 22.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.629 -179.458 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -92.71 -26.9 17.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.259 -179.319 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.3 t -104.87 19.3 20.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.168 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 44.6 t -58.14 -51.2 70.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.027 0.442 . . . . 0.0 110.486 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -52.03 -51.85 54.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.551 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -60.7 -42.03 96.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.647 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -53.06 -48.61 67.55 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.001 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.02 -38.22 96.24 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 -179.538 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.22 -44.14 97.75 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.685 0.279 . . . . 0.0 110.804 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.9 mt -72.23 -46.36 58.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.977 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 61.1 tp -58.25 -45.89 86.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.02 0.438 . . . . 0.0 110.261 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.8 m -49.47 -27.72 4.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.832 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 71.2 m -91.92 31.66 1.22 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.7 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.4 t -67.22 -8.92 35.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.267 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.2 p-10 -82.56 9.53 9.17 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 120.917 -0.313 . . . . 0.0 111.299 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 p -89.48 19.7 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-O 120.812 0.339 . . . . 0.0 110.776 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 115.56 -17.12 16.35 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 111.235 -0.746 . . . . 0.0 111.235 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 81.7 p -94.74 29.71 2.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.832 0.349 . . . . 0.0 110.569 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -92.81 23.6 4.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.738 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.7 m -92.82 28.5 2.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.581 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -119.24 25.12 10.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.646 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -48.58 114.09 1.84 Allowed Glycine 0 CA--C 1.526 0.73 0 N-CA-C 111.091 -0.804 . . . . 0.0 111.091 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -66.89 -33.73 76.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.775 0.322 . . . . 0.0 110.662 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.3 ptt-85 -61.31 -16.24 43.77 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.051 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -82.59 -25.34 33.32 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.824 0.345 . . . . 0.0 110.654 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.452 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -59.87 -42.51 93.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.805 -179.762 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.3 p -77.8 -28.85 15.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.779 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -64.51 -45.98 84.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.661 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.0 p -73.61 -36.24 46.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.672 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.452 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -48.32 -49.92 32.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.043 179.984 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 40.3 mmtm -63.28 -40.32 97.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.921 0.391 . . . . 0.0 110.488 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -69.43 -21.96 63.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.791 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -114.92 74.59 3.53 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.626 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -67.52 -6.8 17.45 Favored 'Trans proline' 0 C--N 1.307 -1.625 0 C-N-CA 122.79 2.327 . . . . 0.0 112.473 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.4 tt -61.18 -42.15 98.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.729 0.3 . . . . 0.0 110.401 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 34.5 p-10 -54.67 -25.25 25.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.582 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -74.79 -47.56 30.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.505 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.0 mt . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.353 -179.958 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 49.1 m . . . . . 0 N--CA 1.47 0.538 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.0 p30 -106.63 30.63 5.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.602 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.2 t -148.87 150.55 33.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.594 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.53 -21.4 64.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.068 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 98.4 m -58.96 -38.48 79.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.783 0.325 . . . . 0.0 110.675 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 47.7 t -58.51 -44.54 89.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.716 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.57 -39.65 91.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.685 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 98.8 m -59.63 -48.67 80.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.577 -179.273 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -75.28 -30.96 60.58 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.717 -178.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.17 -22.98 38.53 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.897 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 63.3 tp -74.41 -45.17 48.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.601 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.82 -44.53 86.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.977 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.73 -41.69 98.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.789 0.328 . . . . 0.0 110.804 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -66.98 -36.68 82.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.811 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.538 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -58.68 -62.01 2.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.331 -179.593 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.538 ' N ' HD13 ' A' ' 27' ' ' LEU . 34.4 m -54.53 -19.48 3.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.482 -179.573 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -97.19 -18.92 18.97 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.267 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.5 t -104.44 19.39 20.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.053 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 41.8 t -54.15 -51.96 62.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.865 0.364 . . . . 0.0 110.382 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 -48.9 -52.23 25.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.411 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.7 m120 -60.14 -41.83 93.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.522 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -56.92 -49.45 75.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.774 0.321 . . . . 0.0 110.715 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.36 -41.63 99.38 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.889 -0.885 . . . . 0.0 110.889 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.75 -44.18 97.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.706 0.289 . . . . 0.0 111.049 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 80.7 mt -70.82 -45.97 70.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.167 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 57.7 tp -61.48 -43.72 98.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.869 0.366 . . . . 0.0 110.556 -179.663 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.7 m -52.32 -24.37 7.42 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.859 -179.594 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 72.4 m -90.79 35.85 0.9 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.783 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.0 t -85.68 48.82 1.65 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.673 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.4 p-10 -78.49 0.8 24.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.176 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 10.0 p -65.08 -25.47 37.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 CA-C-O 120.824 0.345 . . . . 0.0 110.671 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 117.86 22.61 3.88 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 111.126 -0.79 . . . . 0.0 111.126 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 78.8 p -110.32 28.23 8.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.794 0.33 . . . . 0.0 110.563 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 48.9 p-10 -95.93 26.45 4.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.575 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.2 m -91.4 24.48 2.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.771 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 41.7 p90 -120.3 24.27 10.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.601 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -55.91 147.3 30.08 Favored Glycine 0 CA--C 1.525 0.656 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -62.81 -37.2 85.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.702 0.287 . . . . 0.0 110.591 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.1 ptt-85 -66.13 -18.26 65.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.006 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -73.66 -25.34 60.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.749 0.309 . . . . 0.0 110.579 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.453 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -57.69 -40.63 79.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.778 -179.694 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -75.21 -30.67 23.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.608 -179.792 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -61.69 -49.01 78.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.724 0.297 . . . . 0.0 110.797 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.407 HG13 ' N ' ' A' ' 57' ' ' LEU . 10.3 p -70.78 -39.99 76.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.603 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.453 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.5 OUTLIER -48.46 -56.17 8.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.064 179.987 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -65.34 -33.91 77.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.974 0.416 . . . . 0.0 110.635 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -63.49 -35.24 79.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.822 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -114.19 75.17 3.05 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.789 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -68.02 -9.49 25.87 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 C-N-CA 122.752 2.301 . . . . 0.0 112.498 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.0 tt -60.23 -42.43 95.19 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.766 0.317 . . . . 0.0 110.394 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 24.0 p-10 -50.41 -29.9 11.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.484 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -74.69 -44.62 49.23 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.618 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.5 mt . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.288 -179.99 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.855 0.359 . . . . 0.0 110.654 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -120.09 -36.49 3.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.755 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.6 t -67.24 145.46 55.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.697 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.13 -17.58 28.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.215 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 96.0 m -63.23 -38.71 92.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.739 0.304 . . . . 0.0 110.688 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 52.4 t -59.15 -50.17 75.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.601 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.16 -39.09 89.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.664 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 97.5 m -47.94 -46.11 31.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.358 -179.455 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -68.72 -28.24 66.65 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.838 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.3 tpp85 -72.22 -44.28 63.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.878 0.37 . . . . 0.0 110.535 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 62.6 tp -57.93 -46.7 84.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.637 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.98 -45.84 71.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.74 -179.605 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -68.19 -40.55 82.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.908 0.385 . . . . 0.0 110.564 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -64.91 -27.35 68.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.926 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.516 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.8 tm? -61.34 -61.7 2.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.376 -179.592 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.516 ' N ' HD13 ' A' ' 27' ' ' LEU . 32.8 m -69.4 -18.38 22.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.478 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -80.63 -38.03 29.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.838 0.352 . . . . 0.0 110.74 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.9 t -94.67 18.82 10.88 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.237 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.7 t -58.84 -48.45 81.29 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.108 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -50.43 -56.4 11.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.074 179.653 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -56.74 -44.89 82.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.885 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -55.23 -54.5 42.59 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.705 0.288 . . . . 0.0 111.313 -179.386 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.69 -38.4 94.49 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 111.356 -0.697 . . . . 0.0 111.356 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.72 -40.7 95.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.807 0.337 . . . . 0.0 110.667 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.4 mt -68.2 -43.53 84.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.997 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 56.8 tp -65.42 -41.67 93.32 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.154 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.7 m -59.23 -35.22 73.26 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.501 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 52.5 m -91.56 35.39 0.95 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.673 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.9 t -56.72 -20.94 24.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.932 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 47.1 p-10 -56.21 -18.33 9.99 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.014 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.2 p -51.89 -25.18 5.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 120.731 0.301 . . . . 0.0 110.721 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 148.11 -14.48 1.3 Allowed Glycine 0 CA--C 1.528 0.864 0 N-CA-C 111.459 -0.656 . . . . 0.0 111.459 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 81.6 p -91.94 34.0 1.03 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.757 0.313 . . . . 0.0 110.68 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 44.7 p-10 -73.96 -0.81 17.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.375 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.5 m -92.13 28.12 1.98 Allowed 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.73 0.3 . . . . 0.0 110.606 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 13.0 p90 -98.53 19.27 14.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.924 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.59 102.64 0.06 OUTLIER Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm -80.18 -23.04 41.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.776 0.322 . . . . 0.0 110.661 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.1 ptt-85 -59.55 -19.01 45.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.946 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -62.61 -25.83 68.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.77 0.319 . . . . 0.0 110.608 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.459 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -54.73 -38.23 66.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.695 -179.647 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -76.83 -30.35 18.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.631 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -63.18 -51.01 68.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.665 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.407 HG13 ' N ' ' A' ' 57' ' ' LEU . 9.2 p -65.62 -39.27 84.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.502 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.459 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -47.74 -56.03 8.26 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.812 -179.843 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 40.5 mmtm -62.8 -35.34 79.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.935 0.398 . . . . 0.0 110.441 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.0 tmt_? -61.91 -37.49 84.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.601 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -110.66 76.11 1.11 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.509 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -64.57 -14.9 47.11 Favored 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.64 2.227 . . . . 0.0 112.409 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.2 tt -53.18 -41.41 65.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.425 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 30.2 p-10 -48.79 -29.97 5.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.582 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -74.72 -47.86 29.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.684 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.1 mt . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.396 -179.857 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.869 0.366 . . . . 0.0 110.498 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -120.86 -36.52 3.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.699 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 13.3 t -61.2 145.28 51.72 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.538 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.54 -18.95 55.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.508 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 93.4 m -65.13 -39.83 93.6 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.782 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 52.3 t -63.3 -48.87 76.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.665 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.18 -39.07 91.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.609 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.465 ' HA ' HD21 ' A' ' 23' ' ' LEU . 89.9 m -48.63 -41.41 31.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.235 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -80.13 -26.4 39.45 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.123 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -70.93 -55.06 9.22 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.603 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.465 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.5 pp -61.01 -31.38 71.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.6 -179.726 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.28 -41.58 89.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.71 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -62.83 -39.82 95.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.859 0.362 . . . . 0.0 110.625 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -65.01 -28.36 69.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.859 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -65.81 -61.78 1.87 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.73 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.2 m -68.52 -18.53 23.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.193 -179.392 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -85.48 -34.18 21.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.886 0.374 . . . . 0.0 110.526 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.6 t -96.39 19.05 12.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.161 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.1 t -57.99 -45.04 87.43 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.178 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -53.31 -55.14 27.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.117 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -57.48 -46.3 83.86 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.979 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -56.29 -54.74 41.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.692 0.282 . . . . 0.0 111.395 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.23 -35.97 92.26 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 111.246 -0.741 . . . . 0.0 111.246 -179.361 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.29 -40.52 96.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.801 0.334 . . . . 0.0 110.628 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 76.1 mt -68.85 -43.3 82.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.128 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.413 ' O ' HG22 ' A' ' 41' ' ' THR . 65.4 tp -67.55 -42.8 82.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.972 0.415 . . . . 0.0 110.296 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.0 m -62.05 -25.47 67.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.661 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.5 m -92.04 29.91 1.52 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.821 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.413 HG22 ' O ' ' A' ' 38' ' ' LEU . 14.9 t -92.48 30.29 1.54 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.58 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 50.8 p-10 -89.93 20.98 3.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.931 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.7 p -88.7 17.8 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.818 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 144.49 -23.34 2.02 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.049 -0.82 . . . . 0.0 111.049 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 37.8 m -98.2 33.9 2.08 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.803 0.335 . . . . 0.0 110.548 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.0 p-10 -62.19 -12.9 22.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.19 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.2 m -91.43 28.49 1.68 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.75 0.309 . . . . 0.0 110.76 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.3 p90 -95.39 19.93 10.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.795 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -53.58 137.97 37.95 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -70.24 -25.07 63.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.748 0.308 . . . . 0.0 110.679 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -60.3 -20.34 58.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.906 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 35.7 t30 -64.15 -26.71 68.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.783 0.325 . . . . 0.0 110.659 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.45 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -52.84 -39.57 62.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.738 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.25 -29.72 17.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.426 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -62.06 -51.22 68.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.594 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.416 HG13 ' N ' ' A' ' 57' ' ' LEU . 8.8 p -66.84 -40.37 85.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.82 0.343 . . . . 0.0 110.584 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.45 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.5 OUTLIER -50.09 -56.06 12.4 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.838 -179.882 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm -64.0 -27.81 69.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.807 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -64.46 -38.7 91.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.776 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -114.53 75.04 3.32 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.207 0.527 . . . . 0.0 110.388 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -68.48 -17.78 43.66 Favored 'Trans proline' 0 N--CA 1.495 1.577 0 C-N-CA 122.781 2.321 . . . . 0.0 112.553 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.2 tt -54.12 -42.69 69.75 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.775 0.322 . . . . 0.0 110.592 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -55.91 -33.52 64.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.519 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -74.83 -47.81 28.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.576 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.1 mt . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.414 179.993 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.96 0.409 . . . . 0.0 110.697 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -102.6 -33.87 9.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.665 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.484 HG23 ' H ' ' A' ' 18' ' ' CYS . 2.6 t -46.57 145.34 1.87 Allowed 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.985 -179.685 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.85 -21.39 66.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.314 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 97.1 m -71.01 -40.36 71.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.895 0.379 . . . . 0.0 110.901 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.484 ' H ' HG23 ' A' ' 15' ' ' THR . 36.6 t -62.51 -47.61 83.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.683 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.65 -36.91 85.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.801 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.447 ' HA ' HD21 ' A' ' 23' ' ' LEU . 99.8 m -47.84 -45.39 29.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.35 -179.428 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -70.19 -27.97 64.92 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.862 -0.335 . . . . 0.0 111.061 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -74.29 -56.43 4.89 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.788 -0.365 . . . . 0.0 110.713 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.447 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.5 pp -64.61 -30.65 71.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.621 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.27 -46.82 88.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.487 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -61.47 -41.2 96.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.708 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -64.52 -35.61 81.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.651 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.491 ' C ' HD13 ' A' ' 27' ' ' LEU . 2.3 tm? -59.58 -53.42 58.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.118 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 32.6 m -71.06 -18.32 20.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.465 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -95.66 -12.41 25.6 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.562 -179.185 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.6 t -115.5 18.84 15.76 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 121.115 -0.234 . . . . 0.0 110.816 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.3 t -63.99 -46.61 83.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.265 0.555 . . . . 0.0 110.385 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -58.98 -59.13 5.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.88 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 28.1 m120 -59.68 -43.19 94.12 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.979 -179.611 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -52.6 -43.16 65.17 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.906 -0.317 . . . . 0.0 110.824 -179.444 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -59.87 -37.22 92.23 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.645 -0.982 . . . . 0.0 110.645 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.58 -43.5 93.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.721 0.296 . . . . 0.0 110.559 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 80.1 mt -69.31 -44.76 80.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.569 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 64.4 tp -55.98 -50.91 69.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.136 0.493 . . . . 0.0 109.884 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 68.9 m -47.44 -28.75 2.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.881 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 52.2 m -91.05 35.44 0.91 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.693 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.7 t -64.59 -11.25 32.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.16 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -82.1 9.08 9.2 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 120.979 -0.288 . . . . 0.0 111.283 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -89.45 19.22 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 120.954 -0.299 . . . . 0.0 110.812 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 119.23 -17.09 10.62 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 111.261 -0.736 . . . . 0.0 111.261 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 79.8 p -98.02 32.07 2.52 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.818 0.342 . . . . 0.0 110.61 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 49.6 p30 -95.24 25.44 4.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.732 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.64 28.55 1.98 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.518 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -112.71 21.31 15.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.865 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.32 132.02 25.34 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -71.06 -28.38 64.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.728 0.299 . . . . 0.0 110.608 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.4 ptt-85 -56.67 -18.36 12.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.951 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -72.14 -34.92 68.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.76 0.314 . . . . 0.0 110.551 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.458 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -59.88 -42.24 93.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.832 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.46 -29.91 48.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.485 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -71.26 -47.39 57.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.18 -179.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -73.39 -31.32 33.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.145 -179.322 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.458 HD13 ' O ' ' A' ' 53' ' ' ALA . 2.7 mp -64.06 -42.64 96.94 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.923 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -67.42 -39.27 85.47 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.412 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -61.42 -25.19 67.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.533 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -107.11 80.6 0.84 Allowed Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.508 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -63.16 -9.17 16.29 Favored 'Trans proline' 0 N--CA 1.495 1.581 0 C-N-CA 122.371 2.048 . . . . 0.0 112.692 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.4 tt -58.65 -42.29 88.04 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.321 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 39.5 p-10 -75.51 -12.23 60.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.037 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -74.57 -37.11 63.05 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.857 0.36 . . . . 0.0 110.489 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.2 mt . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.31 -179.932 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.513 ' SG ' HG22 ' A' ' 15' ' ' THR . 20.2 t . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.734 0.302 . . . . 0.0 110.695 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 47.2 p30 -87.46 -3.35 59.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.302 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.513 HG22 ' SG ' ' A' ' 13' ' ' CYS . 8.2 t -50.81 156.83 0.89 Allowed 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.835 0.35 . . . . 0.0 110.378 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.66 -34.89 65.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.87 -178.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 98.4 m -61.26 -50.21 73.97 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.947 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.435 ' H ' HG23 ' A' ' 15' ' ' THR . 60.6 m -68.08 -38.9 82.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.793 0.33 . . . . 0.0 110.564 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.17 -38.81 92.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.664 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.6 m -53.17 -47.39 68.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.462 -179.467 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -78.98 -27.01 43.37 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.71 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -64.18 -51.45 63.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.546 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.3 pp -72.62 -25.65 61.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.807 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.15 -52.5 58.54 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.635 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -69.07 -36.63 77.85 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.71 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -60.59 -36.25 78.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.608 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.498 ' C ' HD13 ' A' ' 27' ' ' LEU . 2.4 tm? -60.28 -51.7 68.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.021 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 27.7 m -76.04 -18.54 15.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.291 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -78.22 -41.64 33.76 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.756 0.313 . . . . 0.0 111.162 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.9 t -91.48 18.89 6.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.499 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.9 t -59.27 -50.31 74.49 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.323 -0.551 . . . . 0.0 109.964 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -48.95 -53.43 19.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.157 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -59.21 -44.73 92.26 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.606 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -51.81 -52.2 50.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.102 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -66.74 -35.63 90.02 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.347 -0.701 . . . . 0.0 111.347 -179.605 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.3 -41.25 98.94 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.704 0.288 . . . . 0.0 110.696 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.5 mt -72.42 -44.29 62.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.727 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.41 ' O ' HG22 ' A' ' 41' ' ' THR . 64.8 tp -60.62 -47.57 85.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.997 0.427 . . . . 0.0 110.226 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.4 t -50.04 -30.79 11.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.57 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.7 m -96.08 35.81 1.39 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.725 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.41 HG22 ' O ' ' A' ' 38' ' ' LEU . 13.4 t -91.43 34.17 0.97 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.717 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -91.75 20.79 5.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.811 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 5.4 p -101.54 4.84 10.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.785 0.326 . . . . 0.0 110.803 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 93.01 19.3 36.93 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.11 -0.796 . . . . 0.0 111.11 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 77.8 p -109.73 32.58 4.94 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.772 0.32 . . . . 0.0 110.597 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 46.2 p-10 -99.92 26.23 6.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.702 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.76 23.92 9.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.756 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 8.9 p90 -133.12 22.58 4.12 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.652 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -60.22 145.99 46.13 Favored Glycine 0 CA--C 1.524 0.603 0 N-CA-C 110.977 -0.849 . . . . 0.0 110.977 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -64.09 -36.0 82.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.778 0.323 . . . . 0.0 110.623 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.5 ptt-85 -59.75 -20.36 56.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.725 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.37 -23.63 66.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.627 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.446 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -56.51 -38.84 72.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.795 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -76.13 -32.61 23.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 120.819 -0.353 . . . . 0.0 110.444 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -64.63 -50.44 67.13 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.784 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.44 HG13 ' N ' ' A' ' 57' ' ' LEU . 7.5 p -64.09 -42.53 95.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.62 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.446 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.5 OUTLIER -47.94 -50.03 28.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.015 -179.836 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -61.28 -38.1 85.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.9 0.381 . . . . 0.0 110.522 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.8 tmt_? -65.65 -36.5 83.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.473 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -108.07 88.12 4.43 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.473 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -66.27 -5.65 13.04 Favored 'Trans proline' 0 N--CA 1.495 1.567 0 C-N-CA 122.144 1.896 . . . . 0.0 112.799 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.9 tp -60.94 -42.57 98.47 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.898 -0.321 . . . . 0.0 110.615 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -62.89 -17.34 61.53 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.937 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 55.8 t80 -74.56 -48.04 29.16 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.765 0.317 . . . . 0.0 110.321 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.1 mt . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.335 -179.876 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.916 0.388 . . . . 0.0 110.697 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -114.02 -34.32 5.44 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.744 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -46.9 146.43 1.66 Allowed 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.083 -179.672 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.83 -20.96 66.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.05 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 97.8 m -69.43 -40.46 77.23 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.81 0.338 . . . . 0.0 110.733 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.6 t -60.59 -46.27 90.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.565 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.07 -29.35 69.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.803 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.5 m -61.49 -42.23 98.47 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.584 -179.273 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -74.52 -32.62 62.54 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.799 -178.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.84 -24.27 31.0 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.852 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 14.2 tp -77.86 -40.76 39.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.378 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.7 -45.69 91.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.795 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -63.81 -41.75 97.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.826 0.346 . . . . 0.0 110.624 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -71.2 -28.43 64.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.738 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.539 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -60.37 -62.08 2.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.08 -179.724 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.539 ' N ' HD13 ' A' ' 27' ' ' LEU . 21.3 m -67.8 -18.57 23.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.379 -179.639 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -88.58 -21.24 24.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.121 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.1 t -109.91 18.83 19.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.104 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 44.1 t -63.16 -52.46 62.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.053 0.454 . . . . 0.0 110.415 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -54.12 -57.65 10.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.837 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 29.2 m120 -58.96 -42.02 88.88 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.663 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -52.65 -41.79 64.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.18 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.8 -40.67 99.13 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.62 -42.32 87.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.724 0.297 . . . . 0.0 110.611 -179.582 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.4 mt -70.45 -45.73 73.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.574 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 60.7 tp -55.45 -50.92 68.58 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.944 0.402 . . . . 0.0 110.278 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.5 m -56.89 -36.0 69.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.609 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 75.1 m -90.79 35.85 0.9 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.86 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.43 ' O ' HG23 ' A' ' 41' ' ' THR . 9.6 t -85.22 47.93 1.49 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.858 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 16.4 p-10 -92.41 23.42 3.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.696 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.8 p -88.28 17.72 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.934 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.15 20.35 72.88 Favored Glycine 0 CA--C 1.53 0.974 0 N-CA-C 111.471 -0.651 . . . . 0.0 111.471 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 78.0 p -109.05 31.2 5.88 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.846 0.355 . . . . 0.0 110.359 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 19.8 p-10 -95.79 27.07 3.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.583 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.1 m -68.44 -14.09 62.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.695 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -90.32 20.72 4.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.618 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.19 144.84 7.77 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -62.37 -38.43 89.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.742 0.306 . . . . 0.0 110.509 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 34.8 ptt-85 -62.34 -14.18 36.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.142 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.44 -32.09 42.66 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.541 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.475 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -59.04 -44.6 91.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.803 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -70.2 -29.12 38.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.591 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -65.9 -46.56 77.87 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 121.007 -0.277 . . . . 0.0 110.85 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.5 p -76.62 -33.83 22.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.742 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.475 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -53.18 -50.82 63.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.889 179.935 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -68.61 -38.97 81.01 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.694 -0.403 . . . . 0.0 110.513 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.5 tmt_? -66.37 -22.24 66.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.677 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -108.26 82.59 1.61 Allowed Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.567 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -66.34 -5.96 13.84 Favored 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.375 2.05 . . . . 0.0 112.546 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 61.8 tp -62.74 -42.58 99.73 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -84.52 -8.02 59.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.986 179.377 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -74.85 -28.59 60.74 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-O 120.879 0.371 . . . . 0.0 110.525 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.8 mt . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.177 179.951 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.809 0.338 . . . . 0.0 110.7 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -104.43 -49.41 3.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.794 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.4 t -45.27 154.78 0.15 Allowed 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.013 0.435 . . . . 0.0 111.315 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.53 -18.27 62.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.288 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 99.1 m -63.39 -42.12 98.8 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.762 0.315 . . . . 0.0 110.775 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.6 t -61.85 -44.98 95.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.598 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.51 -34.18 72.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.89 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 78.7 m -62.18 -44.33 96.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.514 -179.292 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -72.67 -32.49 65.85 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.611 -178.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.12 -23.55 30.66 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.851 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 53.8 tp -84.01 -42.08 16.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.639 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.402 ' O ' HG13 ' A' ' 28' ' ' VAL . . . -60.0 -44.49 94.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.96 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.8 m120 -63.5 -38.64 91.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.874 0.369 . . . . 0.0 111.111 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -70.31 -38.7 75.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.078 -179.546 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.503 ' C ' HD13 ' A' ' 27' ' ' LEU . 2.6 tm? -66.32 -51.09 60.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.787 -179.207 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.402 HG13 ' O ' ' A' ' 24' ' ' ALA . 30.9 m -58.87 -21.72 19.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.247 -179.4 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -97.1 -24.67 15.64 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.939 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 73.2 m -95.03 18.82 11.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.171 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.9 t -59.91 -48.44 81.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.226 0.536 . . . . 0.0 109.786 179.554 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -50.89 -53.14 35.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.456 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -61.76 -40.08 93.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.029 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -51.55 -40.44 59.7 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.721 -0.391 . . . . 0.0 110.569 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -59.81 -40.1 96.25 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.51 -43.47 89.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.723 0.297 . . . . 0.0 110.549 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 79.2 mt -69.87 -43.41 79.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.529 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 63.2 tp -56.94 -47.0 81.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.008 0.433 . . . . 0.0 110.151 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.0 m -48.21 -31.71 6.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.84 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 71.1 m -93.6 35.21 1.13 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.849 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.0 t -92.26 34.8 1.02 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.657 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -90.78 22.64 3.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.767 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 p -89.53 19.81 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.785 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 103.63 -13.32 53.93 Favored Glycine 0 CA--C 1.529 0.955 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 88.3 p -91.72 24.5 3.1 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.735 0.302 . . . . 0.0 110.686 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -97.8 26.59 5.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.589 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.49 24.94 2.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.719 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 30.5 p90 -116.34 22.74 12.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.72 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -59.86 155.89 29.25 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -61.6 -36.1 79.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.805 0.336 . . . . 0.0 110.624 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.3 ptt-85 -59.44 -14.91 14.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.146 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.8 t30 -79.98 -32.96 39.81 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.726 0.298 . . . . 0.0 110.571 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.463 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -57.81 -47.3 83.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.791 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 14.7 p -69.99 -31.13 46.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.67 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -64.4 -46.81 81.65 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.649 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 13.2 p -76.69 -31.93 20.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.96 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.463 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.8 OUTLIER -55.47 -48.63 74.23 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 121.005 -0.278 . . . . 0.0 110.901 -179.987 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -65.7 -38.56 89.56 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.3 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -63.84 -23.17 67.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.723 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -108.07 80.43 1.07 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.731 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -66.05 -6.48 14.58 Favored 'Trans proline' 0 N--CA 1.494 1.548 0 C-N-CA 122.456 2.104 . . . . 0.0 112.556 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.6 tt -57.18 -41.66 79.7 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.308 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 31.8 p-10 -70.6 -19.12 62.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.725 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -74.57 -38.44 62.68 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.621 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.6 mt . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.39 -179.938 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.855 0.36 . . . . 0.0 110.728 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 48.0 p30 -112.05 30.78 6.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.456 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.3 t -142.03 151.89 42.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.434 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.6 -20.83 58.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.148 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 95.8 m -62.0 -39.23 91.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.753 0.311 . . . . 0.0 110.826 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 50.8 t -59.37 -49.59 77.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.619 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.75 -43.36 96.68 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.731 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 79.6 m -47.6 -42.43 23.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.458 -179.295 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -82.94 -26.24 31.58 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.141 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.25 -28.08 53.5 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.529 -0.469 . . . . 0.0 111.543 -179.046 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.6 pp -84.65 -32.69 23.52 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.636 179.753 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.0 -47.71 84.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.968 -179.504 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -64.91 -40.25 94.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.822 0.344 . . . . 0.0 111.032 -179.798 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -65.09 -37.79 88.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.96 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.487 ' C ' HD13 ' A' ' 27' ' ' LEU . 2.2 tm? -66.65 -57.77 6.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.577 -179.449 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.1 m -54.18 -21.27 5.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.203 -179.556 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -97.08 -28.35 14.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.837 0.351 . . . . 0.0 110.855 -179.558 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.2 t -97.79 19.45 13.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.126 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 44.1 t -49.9 -48.8 51.36 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.919 0.39 . . . . 0.0 110.117 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -48.04 -51.62 23.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.346 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -59.5 -43.06 93.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.522 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -55.46 -44.11 76.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.853 0.358 . . . . 0.0 110.378 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -62.26 -40.65 99.28 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.734 -0.946 . . . . 0.0 110.734 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.62 -44.78 95.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.675 0.274 . . . . 0.0 110.961 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 82.0 mt -69.99 -46.98 71.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.963 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.417 HD11 ' OH ' ' A' ' 48' ' ' TYR . 49.4 tp -59.23 -45.1 92.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.007 0.432 . . . . 0.0 110.439 -179.818 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 69.5 m -51.21 -25.63 5.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.859 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 68.4 m -91.53 33.09 1.02 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.745 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.7 t -91.98 34.11 1.03 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.646 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -92.73 24.89 3.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.702 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.4 ' O ' HG22 ' A' ' 43' ' ' VAL . 5.4 p -91.41 23.83 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.954 0.407 . . . . 0.0 110.556 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 88.29 20.85 47.32 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 80.7 p -121.5 25.75 9.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.783 0.325 . . . . 0.0 110.556 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.6 p-10 -98.08 26.6 5.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.644 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -90.98 26.31 2.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.843 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.417 ' OH ' HD11 ' A' ' 38' ' ' LEU . 48.7 p90 -123.91 21.09 9.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.714 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -65.45 159.25 45.26 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -63.91 -28.03 69.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.845 0.355 . . . . 0.0 110.575 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 34.9 ptt-85 -62.39 -14.2 37.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.124 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -82.7 -30.76 28.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.733 0.302 . . . . 0.0 110.698 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.456 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -58.89 -43.77 91.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.914 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.7 p -75.05 -29.74 22.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.772 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -61.63 -49.59 75.95 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.805 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.1 p -71.45 -37.68 65.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.677 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.456 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -48.83 -51.43 29.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.975 179.968 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 40.3 mmtm -65.98 -38.21 87.97 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.594 -0.443 . . . . 0.0 110.484 -179.667 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -67.94 -22.62 65.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.841 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -107.33 82.31 1.2 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.724 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -65.48 -6.81 14.38 Favored 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.354 2.036 . . . . 0.0 112.579 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.0 tt -57.48 -42.41 82.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.796 0.332 . . . . 0.0 110.2 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 34.8 p-10 -74.22 -15.26 61.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.836 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -74.7 -29.56 61.24 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.746 0.308 . . . . 0.0 110.615 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.3 mt . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.274 -179.995 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.921 0.391 . . . . 0.0 110.605 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 16.9 p30 -108.05 -28.84 9.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.912 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.513 HG23 ' H ' ' A' ' 18' ' ' CYS . 1.8 t -48.94 145.25 4.04 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.87 0.366 . . . . 0.0 110.669 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.73 -23.69 67.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.512 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 96.8 m -70.34 -43.88 69.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.796 0.332 . . . . 0.0 110.827 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.513 ' H ' HG23 ' A' ' 15' ' ' THR . 22.2 t -62.45 -44.35 96.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.458 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.13 -37.77 88.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.707 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.441 ' HA ' HD21 ' A' ' 23' ' ' LEU . 97.7 m -47.98 -43.45 29.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.199 -179.511 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -72.14 -26.63 62.18 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.825 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -73.52 -49.61 25.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.763 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.441 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.6 pp -73.05 -33.05 65.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.596 -179.795 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.26 -46.39 86.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.808 0.337 . . . . 0.0 110.368 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -60.7 -41.57 95.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.568 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -63.15 -38.65 92.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.736 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.54 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -54.65 -62.03 1.92 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.001 0.429 . . . . 0.0 110.048 -179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.54 ' N ' HD13 ' A' ' 27' ' ' LEU . 27.8 m -63.62 -18.75 22.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.177 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -86.41 -19.46 29.64 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.024 -179.712 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.4 t -85.7 19.07 2.58 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.344 -179.769 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.1 t -61.95 -38.24 87.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.173 0.511 . . . . 0.0 110.523 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 7.7 p-10 -72.9 -51.87 16.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.454 -0.793 . . . . 0.0 111.171 -179.406 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -61.14 -44.3 97.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.993 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -46.07 -57.13 4.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.67 -179.004 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -64.37 -36.34 93.07 Favored Glycine 0 CA--C 1.526 0.732 0 C-N-CA 120.866 -0.683 . . . . 0.0 111.528 -179.137 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.89 -40.83 96.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.636 0.255 . . . . 0.0 110.874 -179.774 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.0 mt -74.17 -42.74 51.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.769 0.319 . . . . 0.0 110.71 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 65.4 tp -59.46 -50.42 74.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.143 0.497 . . . . 0.0 110.056 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.3 m -50.15 -26.9 5.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.786 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.9 m -92.16 29.49 1.63 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.732 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.2 t -59.25 -18.78 40.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.939 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 45.5 p-10 -82.11 8.89 9.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.308 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -89.02 18.42 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-O 120.717 0.294 . . . . 0.0 110.823 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 124.83 -20.45 6.79 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 111.139 -0.784 . . . . 0.0 111.139 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 70.0 p -98.48 34.12 2.09 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.81 0.338 . . . . 0.0 110.57 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -82.84 10.18 8.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.311 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.5 m -92.9 28.48 2.07 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.82 0.343 . . . . 0.0 110.516 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 12.2 p90 -101.87 19.87 17.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.904 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.92 126.61 22.39 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -71.06 -25.79 62.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.783 0.325 . . . . 0.0 110.615 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.3 ptt-85 -68.08 -19.31 64.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.001 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.91 -30.83 62.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.742 0.305 . . . . 0.0 110.691 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.464 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -59.34 -40.45 86.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.072 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -71.9 -29.84 34.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.904 -179.633 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -61.13 -51.3 69.69 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.701 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.428 HG13 ' N ' ' A' ' 57' ' ' LEU . 9.1 p -70.53 -41.81 78.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.495 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.464 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -50.11 -50.73 47.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.895 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm -69.3 -28.1 65.97 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.463 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -61.03 -25.82 67.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.591 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -119.04 75.78 14.53 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.531 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -66.37 -7.36 17.37 Favored 'Trans proline' 0 C--N 1.308 -1.588 0 C-N-CA 122.554 2.17 . . . . 0.0 112.494 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.3 tt -66.76 -36.94 83.62 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.271 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -84.73 -24.51 28.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.557 179.611 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 94.2 t80 -84.82 -24.9 28.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.691 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 64.4 mt . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.365 179.983 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 52.9 m . . . . . 0 N--CA 1.47 0.568 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -103.6 30.44 5.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.659 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.8 t -148.84 147.85 29.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.686 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.61 -20.62 34.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.124 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 97.7 m -59.4 -40.08 85.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.772 0.32 . . . . 0.0 110.704 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 54.0 t -59.22 -44.3 92.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.662 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.36 -41.94 97.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.614 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 98.7 m -59.95 -45.85 91.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.745 -179.259 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -78.85 -29.83 44.84 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.779 -178.805 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.12 -22.65 33.31 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.185 -179.633 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 52.3 tp -83.6 -41.89 17.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.799 0.333 . . . . 0.0 110.54 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.45 -43.64 93.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.867 -179.593 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -63.06 -39.21 94.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.812 0.339 . . . . 0.0 111.0 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -66.03 -39.55 90.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.138 -179.566 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.504 ' C ' HD13 ' A' ' 27' ' ' LEU . 2.5 tm? -65.78 -52.16 53.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.772 -179.267 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.6 m -59.24 -21.74 20.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.186 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -96.01 -25.9 15.75 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.871 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.7 t -100.86 19.22 17.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.135 -179.699 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 41.7 t -53.21 -51.33 62.47 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.922 0.391 . . . . 0.0 110.114 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -47.93 -53.37 16.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.557 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -60.5 -40.76 92.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.661 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -55.88 -39.52 71.67 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.395 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -60.95 -40.9 99.06 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.52 -1.032 . . . . 0.0 110.52 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.78 -43.89 85.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.746 0.308 . . . . 0.0 110.746 -179.745 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.8 mt -67.98 -43.98 85.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.731 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.404 ' O ' HG22 ' A' ' 41' ' ' THR . 60.7 tp -58.73 -48.65 80.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.893 0.377 . . . . 0.0 110.425 -179.743 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 68.8 m -49.02 -32.12 8.79 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.747 -179.56 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.5 m -94.97 35.85 1.24 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.838 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.404 HG22 ' O ' ' A' ' 38' ' ' LEU . 13.8 t -91.67 33.19 1.03 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.734 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.8 p-10 -86.87 14.62 6.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.06 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.1 p -64.76 -22.72 31.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.755 0.312 . . . . 0.0 110.766 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 148.53 -17.82 1.29 Allowed Glycine 0 CA--C 1.528 0.855 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 84.9 p -92.45 26.89 2.44 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.739 0.304 . . . . 0.0 110.542 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -92.3 25.81 2.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.598 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.12 28.41 1.89 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.689 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -117.34 23.93 11.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.695 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -55.43 145.7 31.09 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.009 -0.837 . . . . 0.0 111.009 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.2 mtmm -62.78 -37.88 88.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.77 0.319 . . . . 0.0 110.717 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.3 ptt-85 -62.88 -17.34 61.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.112 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -74.03 -28.79 61.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.804 0.335 . . . . 0.0 110.705 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.467 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -58.71 -41.45 86.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.931 -179.745 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -73.04 -30.93 33.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.814 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -63.39 -50.75 68.65 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.643 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.412 HG13 ' N ' ' A' ' 57' ' ' LEU . 9.9 p -68.94 -39.19 79.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.601 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.467 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -53.26 -51.34 62.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.068 179.958 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -69.61 -35.47 75.3 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.532 -179.65 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.8 tmt_? -61.78 -28.92 69.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.658 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -113.4 75.16 2.29 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.75 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -68.35 -5.96 16.32 Favored 'Trans proline' 0 C--N 1.307 -1.63 0 C-N-CA 122.703 2.269 . . . . 0.0 112.548 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.7 tt -62.36 -41.09 98.33 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.896 0.379 . . . . 0.0 110.267 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -63.8 -32.87 74.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.253 179.679 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -74.9 -38.47 61.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.689 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.7 mt . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.436 -179.928 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.1 m . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.703 0.287 . . . . 0.0 110.665 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -99.23 -44.13 6.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.638 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.9 t -47.15 153.17 0.48 Allowed 'General case' 0 C--O 1.231 0.113 0 CA-C-O 120.892 0.377 . . . . 0.0 110.991 -179.687 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.95 -15.15 62.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.468 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 98.3 m -68.29 -44.48 75.4 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.832 0.349 . . . . 0.0 110.687 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 10.2 t -63.38 -43.09 98.58 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.348 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.07 -36.31 82.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.85 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.431 ' HA ' HD21 ' A' ' 23' ' ' LEU . 64.5 m -49.12 -43.87 41.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.208 -179.448 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -73.47 -26.53 60.95 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.786 -0.366 . . . . 0.0 111.139 -179.372 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -75.83 -39.82 55.99 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.91 -0.316 . . . . 0.0 111.017 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.431 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.4 pp -84.01 -30.45 26.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.6 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.69 -47.67 84.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.475 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.3 m-20 -64.21 -40.39 95.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.725 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -64.34 -36.84 85.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.724 -179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.528 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -53.29 -61.82 2.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.182 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.528 ' N ' HD13 ' A' ' 27' ' ' LEU . 27.1 m -64.42 -19.81 25.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.339 -179.768 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -95.39 -0.3 52.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.655 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.9 t -118.2 16.22 14.04 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.137 -0.225 . . . . 0.0 110.872 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.9 t -64.51 -44.55 90.56 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.223 0.535 . . . . 0.0 110.41 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -58.66 -59.63 5.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.893 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -60.51 -42.19 95.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.987 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -50.16 -43.93 52.43 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.939 -0.304 . . . . 0.0 110.932 -179.487 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -60.81 -37.82 94.27 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.21 -42.14 90.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.587 -0.307 . . . . 0.0 110.514 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.6 mt -69.09 -42.1 81.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.499 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 63.1 tp -58.89 -52.23 66.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.092 0.472 . . . . 0.0 109.922 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.3 t -51.67 -26.2 8.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.546 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.2 m -91.98 28.6 1.8 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.643 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.424 ' O ' HG23 ' A' ' 41' ' ' THR . 9.7 t -85.94 46.98 1.38 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.809 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 -90.66 21.43 4.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.833 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 p -90.16 20.5 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.718 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 85.14 20.99 56.4 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 61.3 p -119.64 29.41 7.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.773 0.321 . . . . 0.0 110.547 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -96.08 26.89 3.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.556 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.8 m -91.98 28.45 1.84 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.678 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.411 ' HE2' HG21 ' A' ' 41' ' ' THR . 41.2 p90 -113.98 22.64 13.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.708 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -64.6 160.44 40.8 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.049 -0.82 . . . . 0.0 111.049 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm -63.16 -31.43 72.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.822 0.344 . . . . 0.0 110.691 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.1 ptt-85 -57.96 -16.48 12.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.024 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -79.85 -26.62 40.32 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.688 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.467 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -59.73 -51.74 68.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.902 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 4.8 p -66.09 -30.29 49.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.563 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -64.67 -47.67 77.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.664 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.95 -29.56 15.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.994 -179.682 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.467 HD13 ' O ' ' A' ' 53' ' ' ALA . 1.5 mp -59.67 -44.25 93.66 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.876 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -66.79 -38.86 87.36 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.273 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -63.78 -25.21 68.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.345 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -108.67 80.48 1.23 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.368 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -65.08 -7.11 14.42 Favored 'Trans proline' 0 N--CA 1.494 1.556 0 C-N-CA 122.457 2.105 . . . . 0.0 112.771 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.0 tt -58.37 -41.04 83.88 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.377 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 -71.34 -13.9 62.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.917 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -74.53 -34.4 63.0 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.884 0.373 . . . . 0.0 110.404 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.1 mt . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.382 179.971 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 49.0 m . . . . . 0 N--CA 1.469 0.499 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 23.2 p30 -103.51 30.47 4.97 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.49 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 10.6 t -146.03 149.64 34.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.684 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.91 -22.09 65.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.211 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 97.4 m -60.29 -39.2 86.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.927 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 50.4 t -58.94 -48.28 82.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.764 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.63 -43.65 98.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.726 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.3 m -48.58 -42.86 35.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.305 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -82.95 -26.35 31.46 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -179.232 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.48 -27.79 61.58 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.616 -0.434 . . . . 0.0 111.55 -179.046 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.4 pp -84.51 -29.24 26.14 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.701 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.1 -50.27 74.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.67 -179.656 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -63.59 -42.52 98.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.919 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -62.13 -39.15 91.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.946 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.517 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.9 tm? -66.56 -61.53 1.93 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.546 -179.489 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.517 ' N ' HD13 ' A' ' 27' ' ' LEU . 24.3 m -55.46 -20.97 8.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.294 -179.596 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -97.13 -21.85 17.09 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.225 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.2 t -97.19 19.1 13.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.28 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 41.5 t -55.42 -53.05 61.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.035 0.445 . . . . 0.0 109.848 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -48.01 -51.23 24.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.44 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -61.3 -40.13 93.01 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.841 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -53.47 -39.05 64.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.777 0.322 . . . . 0.0 110.637 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.98 -43.87 96.78 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 110.569 -1.012 . . . . 0.0 110.569 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.34 -43.14 92.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.711 0.291 . . . . 0.0 110.818 -179.662 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.5 mt -66.56 -47.59 83.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.879 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.404 ' O ' HG22 ' A' ' 41' ' ' THR . 63.3 tp -58.97 -45.64 90.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.897 0.379 . . . . 0.0 110.51 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 71.1 m -49.52 -29.77 7.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.729 -179.634 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 68.5 m -94.06 34.13 1.28 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.739 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.404 HG22 ' O ' ' A' ' 38' ' ' LEU . 14.5 t -92.6 31.18 1.39 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.617 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 43.3 p-10 -94.06 23.49 4.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.741 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 p -89.34 19.71 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.806 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 112.05 -18.61 23.69 Favored Glycine 0 CA--C 1.527 0.792 0 N-CA-C 111.192 -0.763 . . . . 0.0 111.192 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 87.3 p -92.06 24.9 3.06 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.809 0.337 . . . . 0.0 110.63 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 50.3 p-10 -96.58 26.89 4.14 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.652 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.4 m -87.94 19.51 3.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.068 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 12.9 p90 -116.71 22.44 12.69 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.799 0.333 . . . . 0.0 110.55 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -58.79 153.93 28.54 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -61.79 -36.23 80.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.792 0.329 . . . . 0.0 110.692 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.2 ptt-85 -59.91 -15.56 22.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.98 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -80.25 -35.0 36.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.756 0.312 . . . . 0.0 110.547 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.414 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -58.99 -44.64 91.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.762 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 14.5 p -71.84 -32.16 43.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.638 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -62.09 -50.7 70.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.678 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 11.2 p -72.03 -32.77 45.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.928 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.414 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -53.77 -45.61 70.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.92 179.945 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -67.91 -40.46 83.4 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.39 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -63.55 -24.42 67.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.623 179.829 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -108.0 79.5 0.91 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.432 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -64.6 -7.67 15.19 Favored 'Trans proline' 0 N--CA 1.494 1.528 0 C-N-CA 122.361 2.041 . . . . 0.0 112.584 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.5 tt -63.81 -42.52 97.67 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.159 179.62 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -82.53 -5.18 58.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.957 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -74.5 -35.12 63.21 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-O 120.823 0.344 . . . . 0.0 110.489 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.3 mt . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.292 179.957 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.774 0.321 . . . . 0.0 110.685 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 12.8 p30 -125.66 -40.41 2.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.892 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.2 t -53.52 152.1 5.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.929 0.395 . . . . 0.0 110.878 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.62 -19.72 64.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.356 -179.557 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 92.3 m -65.03 -37.16 86.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.82 0.343 . . . . 0.0 110.706 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.0 t -59.41 -45.56 91.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.655 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.78 -39.18 90.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.725 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.446 ' HA ' HD21 ' A' ' 23' ' ' LEU . 59.4 m -47.32 -43.58 22.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.385 -179.361 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -77.14 -26.91 53.65 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.804 -0.358 . . . . 0.0 111.043 -179.485 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.7 tpp85 -69.26 -50.11 50.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.761 0.315 . . . . 0.0 110.53 -179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.446 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.5 pp -70.59 -31.72 68.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.65 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.81 -48.81 77.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.533 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -66.88 -40.13 87.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.868 0.366 . . . . 0.0 110.535 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -62.37 -27.77 69.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.908 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.516 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.8 tm? -64.46 -61.89 1.94 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.872 0.368 . . . . 0.0 110.254 -179.749 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.516 ' N ' HD13 ' A' ' 27' ' ' LEU . 19.7 m -70.67 -18.51 21.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.367 -179.707 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -82.18 -38.02 25.25 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.843 0.354 . . . . 0.0 110.889 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.88 19.13 18.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.203 -179.536 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.7 t -55.78 -49.35 73.39 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.129 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -50.58 -54.4 22.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.132 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -56.56 -45.83 81.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.629 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -53.55 -53.34 53.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.746 0.308 . . . . 0.0 111.124 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -67.38 -33.87 83.36 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.204 -0.758 . . . . 0.0 111.204 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.29 -42.88 99.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.735 0.302 . . . . 0.0 110.793 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.4 mt -66.09 -44.49 91.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.951 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.3 tp -65.27 -42.49 93.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.95 0.405 . . . . 0.0 110.12 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.8 m -58.89 -36.88 75.38 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.577 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 67.9 m -91.64 35.76 0.95 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.667 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.413 HG21 ' CZ ' ' A' ' 48' ' ' TYR . 9.1 t -56.62 -17.73 9.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.038 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.1 p-10 -79.32 5.01 13.53 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.359 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.6 p -88.58 16.53 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.01 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 148.14 -27.69 1.4 Allowed Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 5.9 p -99.22 34.08 2.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.849 0.357 . . . . 0.0 110.44 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.8 p-10 -63.88 -10.72 22.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.383 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -90.7 28.05 1.62 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.782 0.325 . . . . 0.0 110.818 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.413 ' CZ ' HG21 ' A' ' 41' ' ' THR . 13.8 p90 -90.01 20.01 4.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.846 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -48.04 102.6 0.05 OUTLIER Glycine 0 CA--C 1.525 0.662 0 N-CA-C 111.141 -0.783 . . . . 0.0 111.141 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.9 mtmm -79.4 -20.12 48.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.718 0.294 . . . . 0.0 110.83 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.4 ptt-85 -58.73 -15.82 13.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.139 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -74.93 -24.97 58.58 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.765 0.317 . . . . 0.0 110.749 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.459 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -58.02 -44.47 87.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.073 -179.574 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 1.6 p -77.31 -30.38 17.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.728 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -65.26 -46.34 80.92 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.791 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.407 HG13 ' N ' ' A' ' 57' ' ' LEU . 13.6 p -71.67 -38.51 66.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 120.85 -0.34 . . . . 0.0 110.577 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.459 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -49.56 -54.71 16.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.791 -179.982 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -64.3 -31.69 73.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.698 -179.525 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -62.71 -37.51 86.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.659 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -115.65 76.61 5.73 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.618 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -67.4 -13.03 37.92 Favored 'Trans proline' 0 C--N 1.308 -1.581 0 C-N-CA 122.7 2.267 . . . . 0.0 112.48 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 25.5 tp -58.81 -42.69 89.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.774 0.321 . . . . 0.0 110.402 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -50.7 -35.66 32.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.495 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 91.3 t80 -75.51 -47.91 24.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.69 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.7 mt . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.373 -179.975 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.847 0.356 . . . . 0.0 110.59 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -108.52 -37.78 5.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.603 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.451 HG23 ' H ' ' A' ' 18' ' ' CYS . 14.8 t -49.88 150.96 1.99 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.342 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.14 -15.68 63.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.708 -179.283 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 95.5 m -69.34 -40.41 77.58 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.984 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.451 ' H ' HG23 ' A' ' 15' ' ' THR . 15.5 t -64.49 -49.25 72.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.831 -179.533 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.56 -40.76 96.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.916 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.424 ' HA ' HD23 ' A' ' 23' ' ' LEU . 9.1 m -48.91 -34.46 12.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.228 -179.396 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -80.44 -26.26 38.48 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.571 -179.226 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.8 -25.65 60.22 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.544 -0.462 . . . . 0.0 111.288 -179.196 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' A' ' 20' ' ' THR . 1.5 pp -84.36 -26.38 28.46 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.567 179.853 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.39 -51.37 69.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.827 0.346 . . . . 0.0 110.486 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -64.29 -40.3 95.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.667 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -63.92 -36.71 84.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.646 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.555 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -56.1 -62.46 1.69 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.149 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.555 ' N ' HD13 ' A' ' 27' ' ' LEU . 25.7 m -66.45 -19.21 25.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.311 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -84.98 -13.18 51.45 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.322 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.8 t -85.72 19.03 2.6 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 121.098 -0.241 . . . . 0.0 111.248 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.6 t -60.59 -37.37 81.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.961 0.41 . . . . 0.0 110.774 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.3 p-10 -81.79 -50.16 9.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.237 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.439 ' O ' HD12 ' A' ' 37' ' ' ILE . 28.0 m120 -59.04 -44.24 91.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.109 -179.636 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -45.25 -56.31 4.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.484 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.27 -31.4 80.6 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 111.007 -0.837 . . . . 0.0 111.007 -179.592 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.27 -42.72 96.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.665 0.269 . . . . 0.0 110.674 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.439 HD12 ' O ' ' A' ' 33' ' ' ASN . 1.6 mp -70.2 -44.07 78.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.69 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.425 HD11 ' OH ' ' A' ' 48' ' ' TYR . 62.9 tp -60.81 -50.55 73.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.277 0.561 . . . . 0.0 109.833 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 71.2 m -48.9 -29.21 4.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.638 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.411 ' O ' HG12 ' A' ' 43' ' ' VAL . 56.3 m -90.97 36.0 0.91 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.75 -179.876 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.8 t -56.27 -21.69 25.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.901 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.0 p-10 -83.2 9.83 9.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.313 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.411 HG12 ' O ' ' A' ' 40' ' ' SER . 6.6 p -84.93 -21.57 7.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.761 0.315 . . . . 0.0 110.677 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 129.4 22.69 1.18 Allowed Glycine 0 CA--C 1.528 0.85 0 N-CA-C 111.079 -0.809 . . . . 0.0 111.079 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 84.5 p -124.59 33.91 5.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.844 0.354 . . . . 0.0 110.417 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 48.9 p30 -92.13 26.84 2.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.759 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.7 m -91.3 27.61 1.88 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.836 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.425 ' OH ' HD11 ' A' ' 38' ' ' LEU . 35.5 p90 -126.07 25.65 6.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.629 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.1 123.92 12.21 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -65.92 -36.73 84.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.775 0.321 . . . . 0.0 110.701 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 7.1 ptp180 -63.1 -19.2 64.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.034 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -74.29 -29.79 61.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.802 0.334 . . . . 0.0 110.653 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.468 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -58.72 -41.48 86.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.032 -179.758 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -71.91 -29.84 34.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.856 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -60.77 -52.2 66.09 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.606 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.408 HG13 ' N ' ' A' ' 57' ' ' LEU . 10.3 p -70.17 -39.72 77.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.56 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.468 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -53.53 -46.3 70.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.91 179.876 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -66.82 -39.48 87.71 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.374 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -66.04 -24.79 66.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.505 179.689 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.417 ' O ' ' ND2' ' A' ' 63' ' ' ASN . 75.2 mm-40 -105.83 85.48 1.55 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.509 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -63.68 -8.19 14.76 Favored 'Trans proline' 0 N--CA 1.495 1.573 0 C-N-CA 122.25 1.967 . . . . 0.0 112.67 -179.858 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.4 tt -59.28 -42.38 91.11 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.24 179.584 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.417 ' ND2' ' O ' ' A' ' 60' ' ' GLU . 2.5 p30 -78.63 -10.43 59.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.008 179.794 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -74.43 -39.13 62.79 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.797 0.332 . . . . 0.0 110.543 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.3 mt . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.297 179.966 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.891 0.376 . . . . 0.0 110.739 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 48.2 p30 -113.01 23.89 12.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.837 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.6 t -130.7 154.11 48.27 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.458 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.04 -19.89 55.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.259 -179.514 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 98.1 m -63.21 -41.68 99.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.754 0.311 . . . . 0.0 110.896 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 44.1 t -60.35 -45.45 93.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.609 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.4 -40.62 97.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.729 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.458 ' HA ' HD21 ' A' ' 23' ' ' LEU . 84.8 m -45.79 -42.76 12.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.454 -179.36 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -82.1 -26.63 33.42 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.953 -179.605 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.5 tpp85 -66.97 -49.65 64.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.749 0.309 . . . . 0.0 110.708 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.458 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.6 pp -64.56 -32.64 74.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.499 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.66 -44.36 90.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.492 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -64.39 -40.79 96.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.937 0.399 . . . . 0.0 110.529 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -62.04 -33.68 74.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.903 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.533 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -58.88 -62.09 2.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.118 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.533 ' N ' HD13 ' A' ' 27' ' ' LEU . 29.2 m -64.48 -18.42 23.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.357 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -86.44 -28.32 23.58 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.023 -179.684 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.2 t -96.49 19.21 12.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.244 -179.486 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 40.4 t -55.53 -56.72 17.03 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.283 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -49.15 -50.18 38.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.408 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 28.3 m120 -58.24 -43.6 87.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.738 179.767 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -53.79 -50.07 66.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.724 0.297 . . . . 0.0 110.94 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -64.79 -39.44 96.61 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.88 -43.17 98.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.743 0.306 . . . . 0.0 110.802 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 80.1 mt -69.34 -44.54 80.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.883 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 62.1 tp -61.0 -44.17 97.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.985 0.421 . . . . 0.0 110.181 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.5 m -53.48 -34.78 59.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.607 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.1 m -91.08 35.71 0.91 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.675 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.8 t -57.3 -17.49 12.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.006 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 33.4 p-10 -53.86 -22.15 9.19 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.697 0.284 . . . . 0.0 110.784 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 9.8 p -52.55 -24.1 5.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.68 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 130.58 26.89 0.77 Allowed Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 78.9 p -122.77 28.65 7.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.743 0.306 . . . . 0.0 110.499 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 -93.15 21.63 5.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.807 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.0 m -92.98 28.55 2.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.818 0.342 . . . . 0.0 110.566 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 19.7 p90 -122.33 24.61 9.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.623 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.1 119.2 5.85 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -70.72 -25.46 62.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.765 0.317 . . . . 0.0 110.666 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -67.11 -18.67 65.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.015 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.25 -25.48 55.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.811 0.339 . . . . 0.0 110.702 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.37 -39.89 88.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.969 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -78.18 -30.14 15.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.639 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -62.77 -49.91 73.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.712 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.426 HG13 ' N ' ' A' ' 57' ' ' LEU . 8.8 p -66.82 -40.92 86.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.592 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.426 ' N ' HG13 ' A' ' 56' ' ' VAL . 0.4 OUTLIER -52.91 -51.89 59.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.96 -179.943 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -63.57 -22.21 66.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.831 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -67.28 -34.79 78.16 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.78 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -123.98 75.05 57.92 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.67 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -68.49 -19.92 42.23 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 122.737 2.292 . . . . 0.0 112.3 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.4 tt -60.89 -42.83 98.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.596 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -66.15 -32.81 74.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.747 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -74.73 -41.46 60.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.788 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.9 mt . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.426 -179.771 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 11.9 m . . . . . 0 N--CA 1.47 0.532 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.2 p30 -105.7 30.63 5.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.598 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.5 t -143.09 147.79 35.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.751 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.6 -26.61 65.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.161 -179.561 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 95.1 m -58.01 -38.68 76.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.98 -179.499 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 48.3 t -59.82 -45.04 93.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.862 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.68 -44.4 93.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.651 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 96.9 m -56.06 -43.99 78.47 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.19 -179.484 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -73.94 -56.14 5.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.722 -179.145 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.43 -27.58 64.45 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.348 -179.225 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.3 tp -71.52 -47.94 52.05 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.814 -0.355 . . . . 0.0 110.462 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.88 -42.27 93.37 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.95 -179.536 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -63.91 -39.36 93.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.838 0.351 . . . . 0.0 110.949 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -71.88 -36.44 70.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.959 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.485 ' C ' HD13 ' A' ' 27' ' ' LEU . 2.0 tm? -63.98 -59.44 4.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.55 -179.422 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.454 ' N ' HD13 ' A' ' 27' ' ' LEU . 35.8 m -51.08 -22.99 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.396 -179.505 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -94.75 -30.6 14.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.819 0.342 . . . . 0.0 110.896 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.4 t -99.31 19.51 15.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.192 -179.737 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.7 t -49.48 -50.38 41.59 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.778 0.323 . . . . 0.0 110.316 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 -46.93 -52.08 15.39 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.462 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.8 m-20 -56.98 -44.92 83.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.386 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -57.01 -45.69 82.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.823 0.344 . . . . 0.0 110.431 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -62.04 -49.69 72.82 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.41 -42.07 81.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.719 0.295 . . . . 0.0 110.908 -179.514 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 77.3 mt -63.87 -48.57 85.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.952 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.1 tp -62.97 -39.07 93.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.785 0.326 . . . . 0.0 110.555 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.2 t -49.58 -31.04 9.72 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.63 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 70.9 m -90.52 36.03 0.89 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.824 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.8 t -85.61 15.86 4.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.226 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -92.75 15.57 14.28 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.978 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.3 p -90.63 19.92 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 CA-C-O 120.785 0.326 . . . . 0.0 110.749 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 108.78 20.52 8.01 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 111.176 -0.769 . . . . 0.0 111.176 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 77.2 p -125.36 28.43 6.31 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.798 0.332 . . . . 0.0 110.479 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -94.37 22.07 6.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.855 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.4 m -93.65 26.26 3.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.627 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 20.1 p90 -118.8 22.43 11.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.803 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -48.94 108.0 0.36 Allowed Glycine 0 CA--C 1.525 0.66 0 N-CA-C 111.022 -0.831 . . . . 0.0 111.022 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -70.18 -27.25 64.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.79 0.329 . . . . 0.0 110.518 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -59.76 -18.69 45.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.933 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.98 -25.8 31.93 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.82 0.343 . . . . 0.0 110.583 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.457 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -61.41 -45.11 95.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.891 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 8.1 p -73.56 -30.61 30.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.6 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -64.26 -45.52 87.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.688 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 14.4 p -75.79 -31.73 23.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.722 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.457 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -61.58 -39.71 92.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.795 0.331 . . . . 0.0 110.626 179.768 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -62.2 -44.67 96.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.717 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -69.48 -38.47 77.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.648 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -76.1 157.31 83.41 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.449 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.46 -4.97 16.25 Favored 'Trans proline' 0 N--CA 1.493 1.492 0 C-N-CA 122.529 2.152 . . . . 0.0 112.692 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.5 tt -55.62 -42.43 74.9 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.862 0.363 . . . . 0.0 110.324 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 11.4 p-10 -77.75 -23.74 49.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.571 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -74.57 -35.4 63.03 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.689 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.2 mt . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.357 -179.951 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.796 0.331 . . . . 0.0 111.056 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -112.83 -36.12 5.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.017 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.471 HG23 ' H ' ' A' ' 18' ' ' CYS . 2.4 t -45.92 145.28 1.53 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.965 0.412 . . . . 0.0 111.096 -179.514 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.94 -21.25 66.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.169 -179.623 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 95.9 m -69.5 -40.86 76.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.815 0.34 . . . . 0.0 110.742 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.471 ' H ' HG23 ' A' ' 15' ' ' THR . 20.4 t -61.57 -46.7 88.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.647 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.31 -36.55 84.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.818 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.5 m -47.77 -41.88 24.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.09 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -76.22 -26.57 56.2 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.765 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -71.61 -44.08 65.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.853 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.6 pp -78.61 -30.42 46.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.803 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.48 -49.98 75.39 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.264 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -63.9 -38.6 91.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.417 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -62.79 -34.72 77.86 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.822 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.533 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -57.84 -61.98 2.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.974 0.416 . . . . 0.0 110.107 -179.764 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.533 ' N ' HD13 ' A' ' 27' ' ' LEU . 34.2 m -67.6 -18.61 24.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.544 -179.54 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -87.61 -21.89 25.07 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.293 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.0 t -100.81 19.04 17.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.266 -179.413 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.2 t -62.36 -52.8 62.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.979 0.419 . . . . 0.0 110.618 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -54.41 -51.95 63.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.836 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -61.06 -42.88 99.31 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.767 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -48.9 -48.96 42.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.073 -179.545 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.4 -39.52 97.84 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 -179.374 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.36 -43.6 96.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.657 0.265 . . . . 0.0 111.1 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.3 mt -74.59 -43.72 47.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.031 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 65.7 tp -58.93 -48.59 80.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.934 0.397 . . . . 0.0 110.491 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.7 m -48.95 -27.32 3.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.719 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.9 m -90.76 36.12 0.9 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.695 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 6.3 t -86.37 45.64 1.26 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.732 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 48.1 p-10 -98.61 21.16 11.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.708 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -88.45 15.9 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.78 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 100.91 8.94 47.06 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 59.4 p -109.39 26.22 10.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.786 0.327 . . . . 0.0 110.514 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -92.5 24.5 3.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.652 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.46 23.48 3.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.715 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 21.6 p90 -106.9 18.78 21.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.596 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -52.16 142.4 23.22 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -61.77 -38.64 88.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.757 0.313 . . . . 0.0 110.599 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.0 ptt-85 -67.26 -16.09 64.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.057 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.93 -27.02 36.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.794 0.331 . . . . 0.0 110.617 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.3 -43.17 92.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.908 -179.695 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.2 p -75.48 -29.71 21.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.695 -179.761 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.5 tm-20 -63.58 -47.54 81.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.69 0.281 . . . . 0.0 110.842 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.6 p -72.75 -37.56 55.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.597 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.61 -51.82 65.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.92 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -69.3 -26.79 64.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.883 0.373 . . . . 0.0 110.557 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -67.66 -31.45 71.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.81 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -123.07 74.2 48.51 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.761 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -69.16 -8.23 23.02 Favored 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.821 2.347 . . . . 0.0 112.616 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.3 tt -64.73 -42.59 95.1 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.858 0.361 . . . . 0.0 110.443 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -57.74 -32.05 67.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.533 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -80.13 -43.78 21.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.788 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 32.9 mt . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.364 -179.963 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -73.62 153.21 49.01 Favored 'Trans proline' 0 N--CA 1.492 1.392 0 C-N-CA 122.319 2.013 . . . . 0.0 112.094 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.7 tp -69.04 140.05 19.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.542 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -65.07 141.92 58.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.563 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.3 p -72.26 161.41 30.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.506 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -94.94 21.97 7.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.784 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -82.44 132.49 35.21 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.593 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.4 p -134.2 142.9 39.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.544 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -141.05 70.91 1.35 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.591 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.33 165.68 0.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.601 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.14 164.61 30.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.665 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -59.23 153.05 19.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.723 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.5 m -67.71 80.44 0.19 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.823 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 25.2 p30 -111.49 -17.63 13.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.064 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 13.2 t -87.87 150.23 23.64 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.823 0.344 . . . . 0.0 110.67 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.57 -17.74 56.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.286 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 96.2 m -63.68 -39.24 93.82 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 121.007 -0.277 . . . . 0.0 110.742 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 51.3 t -58.64 -50.71 72.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.724 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.51 -39.87 92.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.646 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.427 ' HA ' HD21 ' A' ' 23' ' ' LEU . 94.9 m -46.34 -42.74 15.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.551 -179.306 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -82.65 -26.89 31.74 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.13 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.5 tpp85 -67.74 -44.79 76.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.716 0.293 . . . . 0.0 110.959 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.427 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.5 pp -69.8 -32.04 70.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.813 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.47 -45.32 88.87 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.933 -0.307 . . . . 0.0 110.655 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 29.5 m120 -65.95 -39.34 90.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.968 0.413 . . . . 0.0 110.542 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -63.99 -33.51 75.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.852 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.549 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -55.33 -62.19 1.83 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.905 0.383 . . . . 0.0 110.236 -179.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.549 ' N ' HD13 ' A' ' 27' ' ' LEU . 31.7 m -62.09 -18.26 19.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.378 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -86.72 -28.4 23.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.025 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.41 19.08 19.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.313 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.0 t -53.55 -51.69 62.11 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.491 -0.484 . . . . 0.0 110.187 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -49.75 -53.89 22.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.202 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -56.77 -43.08 80.47 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.84 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -58.14 -51.1 71.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.709 0.29 . . . . 0.0 111.377 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.83 -44.69 91.57 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 120.974 -0.631 . . . . 0.0 111.527 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.48 -40.98 96.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.739 0.305 . . . . 0.0 110.987 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.2 mt -70.09 -45.19 77.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.066 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.41 HD11 ' CZ ' ' A' ' 48' ' ' TYR . 53.8 tp -64.79 -38.32 90.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.871 0.367 . . . . 0.0 110.471 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.6 m -55.07 -35.15 64.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.709 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 73.3 m -89.38 20.81 3.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.045 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.0 t -55.73 -21.72 20.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.807 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 45.0 p-10 -56.66 -18.04 10.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.974 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.0 p -53.4 -22.84 6.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.678 0.275 . . . . 0.0 110.807 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 148.52 -15.09 1.24 Allowed Glycine 0 CA--C 1.528 0.851 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 80.4 p -92.56 32.53 1.21 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.783 0.325 . . . . 0.0 110.593 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.2 p-10 -94.01 23.4 4.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.824 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.69 28.51 2.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.579 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.41 ' CZ ' HD11 ' A' ' 38' ' ' LEU . 17.7 p90 -118.04 24.35 11.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.684 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -48.18 105.44 0.12 Allowed Glycine 0 CA--C 1.526 0.729 0 N-CA-C 111.061 -0.815 . . . . 0.0 111.061 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -70.58 -24.87 62.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.755 0.312 . . . . 0.0 110.724 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.4 ptt-85 -61.74 -18.4 59.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.904 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -67.54 -24.96 65.6 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.825 0.345 . . . . 0.0 110.608 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.457 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -55.18 -38.77 68.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.702 -179.718 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.57 -30.62 17.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.492 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -63.59 -48.76 76.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.699 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.412 HG13 ' N ' ' A' ' 57' ' ' LEU . 9.0 p -67.81 -39.82 82.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.572 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.457 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -48.2 -56.0 9.03 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.985 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -63.27 -32.15 73.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.961 0.41 . . . . 0.0 110.5 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -66.96 -29.23 69.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.625 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -122.95 74.63 48.05 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.701 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -68.0 -11.15 31.13 Favored 'Trans proline' 0 C--N 1.307 -1.632 0 C-N-CA 122.821 2.347 . . . . 0.0 112.549 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.9 tt -58.78 -42.49 89.14 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.743 0.306 . . . . 0.0 110.487 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 18.3 p-10 -52.13 -31.31 30.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.551 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 93.5 t80 -80.45 -47.84 13.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.698 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.5 mt -68.11 159.0 82.32 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.387 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -52.89 141.73 54.82 Favored 'Trans proline' 0 N--CA 1.494 1.532 0 C-N-CA 122.424 2.083 . . . . 0.0 112.07 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 87.4 mt . . . . . 0 C--O 1.221 -0.444 0 CA-C-O 118.028 -0.986 . . . . 0.0 110.536 179.934 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -69.61 154.74 67.93 Favored 'Trans proline' 0 C--N 1.309 -1.521 0 C-N-CA 122.442 2.095 . . . . 0.0 111.956 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 tp -50.16 133.16 9.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.566 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -70.36 152.45 44.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.513 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 82.6 p -70.8 168.14 17.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.588 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 33.4 p80 -90.5 22.55 3.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.825 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -66.21 141.65 57.98 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.576 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.9 p -126.75 140.2 49.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.568 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -143.59 67.76 1.29 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.551 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -58.11 153.87 13.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.57 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.28 173.71 11.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.665 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -71.44 142.89 50.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.515 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -53.39 95.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.055 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -114.34 -40.36 3.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.904 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.463 HG23 ' H ' ' A' ' 18' ' ' CYS . 15.3 t -51.34 145.71 7.95 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.941 0.4 . . . . 0.0 110.552 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.93 -16.79 63.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.44 -179.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 93.4 m -68.18 -36.65 79.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.797 0.332 . . . . 0.0 110.663 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.463 ' H ' HG23 ' A' ' 15' ' ' THR . 45.5 t -59.95 -48.52 81.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.691 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.0 -33.87 74.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.609 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.8 m -62.08 -47.41 84.78 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.16 -179.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -74.3 -30.93 62.29 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.934 -0.307 . . . . 0.0 111.563 -179.073 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.32 -24.8 36.91 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.68 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.7 tp -75.36 -40.55 57.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.491 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.04 -50.06 74.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.802 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -63.96 -41.41 97.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.891 0.376 . . . . 0.0 110.796 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -67.61 -30.38 69.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.865 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.549 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -59.91 -62.14 2.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.927 0.394 . . . . 0.0 110.176 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.549 ' N ' HD13 ' A' ' 27' ' ' LEU . 28.2 m -65.23 -21.85 30.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.245 -179.617 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -84.51 -25.66 28.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.334 -179.281 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.8 t -100.47 18.97 17.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.257 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.3 t -60.31 -50.44 73.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.195 0.521 . . . . 0.0 110.258 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 14.5 p-10 -54.38 -48.74 71.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.437 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -62.55 -42.03 99.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.891 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -47.87 -50.07 27.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.654 0.264 . . . . 0.0 111.145 -179.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.38 -37.87 95.51 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.12 -44.05 97.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.616 0.245 . . . . 0.0 110.816 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.4 mt -71.8 -44.53 68.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.888 -0.325 . . . . 0.0 110.775 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 59.2 tp -59.37 -45.56 91.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.083 0.468 . . . . 0.0 110.024 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.6 m -51.86 -25.05 7.07 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.779 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.442 ' O ' HG12 ' A' ' 43' ' ' VAL . 69.5 m -91.14 25.35 2.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.76 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 15.3 t -56.73 -21.46 28.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.838 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -80.58 7.68 9.5 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.405 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.442 HG12 ' O ' ' A' ' 40' ' ' SER . 4.3 p -89.98 20.02 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-O 120.815 0.34 . . . . 0.0 110.76 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 115.7 -15.19 17.07 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 111.327 -0.709 . . . . 0.0 111.327 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 80.3 p -102.18 33.58 3.03 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.762 0.315 . . . . 0.0 110.616 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.3 p-10 -91.39 22.71 3.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.784 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.9 m -93.41 28.34 2.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.591 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -99.43 18.65 17.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.954 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.5 108.9 0.51 Allowed Glycine 0 CA--C 1.525 0.689 0 N-CA-C 111.029 -0.828 . . . . 0.0 111.029 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -72.6 -25.74 61.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.829 0.347 . . . . 0.0 110.705 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 34.8 ptt-85 -65.53 -15.09 62.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.11 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -82.34 -32.39 29.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.788 0.327 . . . . 0.0 110.575 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.51 -44.26 89.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.978 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.8 p -72.78 -28.57 27.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.766 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -57.52 -46.78 83.42 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.686 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -68.91 -32.53 54.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.464 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.9 mp -54.77 -54.31 43.76 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.951 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -69.48 -28.13 65.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.935 0.398 . . . . 0.0 110.623 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -65.82 -37.01 85.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.888 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -119.07 75.2 14.33 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.666 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -71.15 -7.08 20.61 Favored 'Trans proline' 0 C--N 1.305 -1.711 0 C-N-CA 122.656 2.237 . . . . 0.0 112.522 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.48 HD21 HD11 ' A' ' 67' ' ' LEU . 3.9 tt -66.8 -42.88 85.23 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.787 0.327 . . . . 0.0 110.626 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -67.02 -30.82 71.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.593 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -76.5 -44.36 35.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.58 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 90.2 mt -72.42 158.94 86.62 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.296 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -51.92 139.72 50.12 Favored 'Trans proline' 0 N--CA 1.494 1.507 0 C-N-CA 122.372 2.048 . . . . 0.0 112.125 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.48 HD11 HD21 ' A' ' 62' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.595 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.515 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -74.36 155.29 46.12 Favored 'Trans proline' 0 C--N 1.308 -1.574 0 C-N-CA 122.569 2.18 . . . . 0.0 112.175 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.4 tp -50.85 137.17 8.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.586 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 -64.01 157.31 25.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.611 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.1 p -71.04 164.6 25.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.522 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.6 p80 -89.6 20.27 4.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.841 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -62.94 135.17 57.16 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.787 0.327 . . . . 0.0 110.591 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.2 p -51.96 135.97 12.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.473 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -146.63 164.7 31.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.62 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -138.9 160.86 38.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.651 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.51 63.45 1.26 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.528 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.1 pttp -52.44 148.97 6.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.581 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.68 90.04 0.27 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.696 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -110.74 -32.38 6.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.72 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.526 HG23 ' H ' ' A' ' 18' ' ' CYS . 2.4 t -47.96 145.14 3.15 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.939 0.399 . . . . 0.0 110.811 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.25 -21.97 66.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.204 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 92.8 m -70.85 -41.6 71.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.853 0.359 . . . . 0.0 110.746 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.526 ' H ' HG23 ' A' ' 15' ' ' THR . 50.9 t -62.08 -47.65 83.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.774 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.51 -36.07 81.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.915 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.43 ' HA ' HD21 ' A' ' 23' ' ' LEU . 91.5 m -49.44 -45.62 46.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.375 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -69.38 -27.81 65.63 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.876 -0.329 . . . . 0.0 111.248 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.5 tpp85 -74.65 -52.51 11.48 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.735 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.43 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.6 pp -68.96 -33.92 74.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.649 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.04 -46.6 85.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.73 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 31.3 m-20 -64.13 -39.95 95.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.867 0.365 . . . . 0.0 110.74 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -62.44 -31.62 72.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.773 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.532 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -64.1 -61.91 1.96 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.272 -179.8 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.532 ' N ' HD13 ' A' ' 27' ' ' LEU . 33.4 m -63.6 -18.45 22.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.629 -179.458 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -92.71 -26.9 17.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.259 -179.319 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.3 t -104.87 19.3 20.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.168 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 44.6 t -58.14 -51.2 70.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.027 0.442 . . . . 0.0 110.486 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -52.03 -51.85 54.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.551 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -60.7 -42.03 96.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.647 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -53.06 -48.61 67.55 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.001 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.02 -38.22 96.24 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 -179.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.22 -44.14 97.75 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.685 0.279 . . . . 0.0 110.804 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.9 mt -72.23 -46.36 58.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.977 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 61.1 tp -58.25 -45.89 86.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.02 0.438 . . . . 0.0 110.261 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.8 m -49.47 -27.72 4.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.832 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 71.2 m -91.92 31.66 1.22 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.7 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.4 t -67.22 -8.92 35.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.267 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.2 p-10 -82.56 9.53 9.17 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 120.917 -0.313 . . . . 0.0 111.299 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 p -89.48 19.7 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-O 120.812 0.339 . . . . 0.0 110.776 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 115.56 -17.12 16.35 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 111.235 -0.746 . . . . 0.0 111.235 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 81.7 p -94.74 29.71 2.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.832 0.349 . . . . 0.0 110.569 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -92.81 23.6 4.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.738 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.7 m -92.82 28.5 2.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.581 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -119.24 25.12 10.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.646 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -48.58 114.09 1.84 Allowed Glycine 0 CA--C 1.526 0.73 0 N-CA-C 111.091 -0.804 . . . . 0.0 111.091 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -66.89 -33.73 76.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.775 0.322 . . . . 0.0 110.662 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.3 ptt-85 -61.31 -16.24 43.77 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.051 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -82.59 -25.34 33.32 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.824 0.345 . . . . 0.0 110.654 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.452 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -59.87 -42.51 93.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.805 -179.762 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.3 p -77.8 -28.85 15.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.779 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -64.51 -45.98 84.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.661 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.0 p -73.61 -36.24 46.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.672 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.452 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -48.32 -49.92 32.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.043 179.984 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 40.3 mmtm -63.28 -40.32 97.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.921 0.391 . . . . 0.0 110.488 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -69.43 -21.96 63.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.791 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -114.92 74.59 3.53 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.626 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -67.52 -6.8 17.45 Favored 'Trans proline' 0 C--N 1.307 -1.625 0 C-N-CA 122.79 2.327 . . . . 0.0 112.473 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.406 ' CD2' HD11 ' A' ' 67' ' ' LEU . 6.4 tt -61.18 -42.15 98.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.729 0.3 . . . . 0.0 110.401 179.85 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 34.5 p-10 -54.67 -25.25 25.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.582 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -74.79 -47.56 30.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.505 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.0 mt -70.22 158.85 86.53 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.353 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -52.55 140.31 55.14 Favored 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 122.403 2.068 . . . . 0.0 112.11 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.406 HD11 ' CD2' ' A' ' 62' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.22 -0.492 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.552 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -73.26 158.57 48.52 Favored 'Trans proline' 0 C--N 1.309 -1.551 0 C-N-CA 122.613 2.209 . . . . 0.0 112.186 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 tp -49.55 137.98 5.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.598 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -62.04 175.75 0.66 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.553 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 82.9 p -68.47 168.59 12.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.517 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.9 p80 -53.36 -25.65 16.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.586 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -65.24 133.13 50.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.531 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.1 p -134.6 141.92 41.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.601 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -148.36 158.67 44.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.528 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.9 pttm -71.82 128.4 35.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.641 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.47 63.24 1.27 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.491 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -88.34 139.98 29.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.632 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 49.1 m 31.84 81.74 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.538 0 O-C-N 124.136 0.898 . . . . 0.0 112.144 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.0 p30 -106.63 30.63 5.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.602 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.2 t -148.87 150.55 33.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.594 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.53 -21.4 64.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.068 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 98.4 m -58.96 -38.48 79.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.783 0.325 . . . . 0.0 110.675 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 47.7 t -58.51 -44.54 89.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.716 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.57 -39.65 91.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.685 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 98.8 m -59.63 -48.67 80.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.577 -179.273 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -75.28 -30.96 60.58 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.717 -178.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.17 -22.98 38.53 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.897 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 63.3 tp -74.41 -45.17 48.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.601 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.82 -44.53 86.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.977 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.73 -41.69 98.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.789 0.328 . . . . 0.0 110.804 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -66.98 -36.68 82.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.811 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.538 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -58.68 -62.01 2.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.331 -179.593 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.538 ' N ' HD13 ' A' ' 27' ' ' LEU . 34.4 m -54.53 -19.48 3.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.482 -179.573 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -97.19 -18.92 18.97 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.267 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.5 t -104.44 19.39 20.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.053 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 41.8 t -54.15 -51.96 62.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.865 0.364 . . . . 0.0 110.382 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 -48.9 -52.23 25.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.411 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.7 m120 -60.14 -41.83 93.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.522 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -56.92 -49.45 75.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.774 0.321 . . . . 0.0 110.715 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.36 -41.63 99.38 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.889 -0.885 . . . . 0.0 110.889 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.75 -44.18 97.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.706 0.289 . . . . 0.0 111.049 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 80.7 mt -70.82 -45.97 70.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.167 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 57.7 tp -61.48 -43.72 98.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.869 0.366 . . . . 0.0 110.556 -179.663 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.7 m -52.32 -24.37 7.42 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.859 -179.594 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 72.4 m -90.79 35.85 0.9 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.783 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.0 t -85.68 48.82 1.65 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.673 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.4 p-10 -78.49 0.8 24.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.176 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 10.0 p -65.08 -25.47 37.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 CA-C-O 120.824 0.345 . . . . 0.0 110.671 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 117.86 22.61 3.88 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 111.126 -0.79 . . . . 0.0 111.126 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 78.8 p -110.32 28.23 8.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.794 0.33 . . . . 0.0 110.563 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 48.9 p-10 -95.93 26.45 4.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.575 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.2 m -91.4 24.48 2.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.771 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 41.7 p90 -120.3 24.27 10.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.601 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -55.91 147.3 30.08 Favored Glycine 0 CA--C 1.525 0.656 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -62.81 -37.2 85.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.702 0.287 . . . . 0.0 110.591 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.1 ptt-85 -66.13 -18.26 65.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.006 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -73.66 -25.34 60.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.749 0.309 . . . . 0.0 110.579 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.453 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -57.69 -40.63 79.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.778 -179.694 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -75.21 -30.67 23.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.608 -179.792 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -61.69 -49.01 78.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.724 0.297 . . . . 0.0 110.797 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.407 HG13 ' N ' ' A' ' 57' ' ' LEU . 10.3 p -70.78 -39.99 76.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.603 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.453 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.5 OUTLIER -48.46 -56.17 8.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.064 179.987 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -65.34 -33.91 77.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.974 0.416 . . . . 0.0 110.635 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -63.49 -35.24 79.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.822 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -114.19 75.17 3.05 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.789 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -68.02 -9.49 25.87 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 C-N-CA 122.752 2.301 . . . . 0.0 112.498 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.0 tt -60.23 -42.43 95.19 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.766 0.317 . . . . 0.0 110.394 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 24.0 p-10 -50.41 -29.9 11.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.484 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -74.69 -44.62 49.23 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.618 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.5 mt -70.22 158.82 86.59 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.288 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -53.2 141.67 58.28 Favored 'Trans proline' 0 N--CA 1.494 1.516 0 C-N-CA 122.353 2.035 . . . . 0.0 112.053 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.219 -0.511 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.505 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -74.18 153.46 46.13 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.555 2.17 . . . . 0.0 112.173 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 tp -54.29 141.32 10.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.581 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 22.8 pt-20 -59.03 139.62 56.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.653 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 95.7 p -86.6 160.94 18.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.66 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.8 p80 -65.05 -23.29 67.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.709 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -60.96 137.74 58.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.5 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 8.9 p -126.5 139.79 50.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.545 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -130.05 59.03 1.64 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.463 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 26.3 pttm -101.65 175.78 5.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.467 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.61 170.46 15.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.642 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.8 pttp -67.05 145.08 55.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.563 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.2 m -57.59 94.96 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.654 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -120.09 -36.49 3.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.755 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.6 t -67.24 145.46 55.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.697 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.13 -17.58 28.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.215 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 96.0 m -63.23 -38.71 92.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.739 0.304 . . . . 0.0 110.688 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 52.4 t -59.15 -50.17 75.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.601 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.16 -39.09 89.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.664 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 97.5 m -47.94 -46.11 31.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.358 -179.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -68.72 -28.24 66.65 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.838 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.3 tpp85 -72.22 -44.28 63.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.878 0.37 . . . . 0.0 110.535 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 62.6 tp -57.93 -46.7 84.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.637 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.98 -45.84 71.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.74 -179.605 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -68.19 -40.55 82.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.908 0.385 . . . . 0.0 110.564 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -64.91 -27.35 68.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.926 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.516 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.8 tm? -61.34 -61.7 2.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.376 -179.592 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.516 ' N ' HD13 ' A' ' 27' ' ' LEU . 32.8 m -69.4 -18.38 22.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.478 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -80.63 -38.03 29.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.838 0.352 . . . . 0.0 110.74 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.9 t -94.67 18.82 10.88 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.237 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.7 t -58.84 -48.45 81.29 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.108 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -50.43 -56.4 11.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.074 179.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -56.74 -44.89 82.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.885 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -55.23 -54.5 42.59 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.705 0.288 . . . . 0.0 111.313 -179.386 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.69 -38.4 94.49 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 111.356 -0.697 . . . . 0.0 111.356 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.72 -40.7 95.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.807 0.337 . . . . 0.0 110.667 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.4 mt -68.2 -43.53 84.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.997 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 56.8 tp -65.42 -41.67 93.32 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.154 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.7 m -59.23 -35.22 73.26 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.501 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 52.5 m -91.56 35.39 0.95 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.673 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.9 t -56.72 -20.94 24.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.932 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 47.1 p-10 -56.21 -18.33 9.99 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.014 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.2 p -51.89 -25.18 5.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 120.731 0.301 . . . . 0.0 110.721 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 148.11 -14.48 1.3 Allowed Glycine 0 CA--C 1.528 0.864 0 N-CA-C 111.459 -0.656 . . . . 0.0 111.459 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 81.6 p -91.94 34.0 1.03 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.757 0.313 . . . . 0.0 110.68 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 44.7 p-10 -73.96 -0.81 17.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.375 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.5 m -92.13 28.12 1.98 Allowed 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.73 0.3 . . . . 0.0 110.606 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 13.0 p90 -98.53 19.27 14.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.924 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.59 102.64 0.06 OUTLIER Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm -80.18 -23.04 41.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.776 0.322 . . . . 0.0 110.661 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.1 ptt-85 -59.55 -19.01 45.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.946 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -62.61 -25.83 68.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.77 0.319 . . . . 0.0 110.608 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.459 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -54.73 -38.23 66.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.695 -179.647 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -76.83 -30.35 18.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.631 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -63.18 -51.01 68.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.665 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.407 HG13 ' N ' ' A' ' 57' ' ' LEU . 9.2 p -65.62 -39.27 84.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.502 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.459 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -47.74 -56.03 8.26 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.812 -179.843 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 40.5 mmtm -62.8 -35.34 79.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.935 0.398 . . . . 0.0 110.441 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.0 tmt_? -61.91 -37.49 84.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.601 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -110.66 76.11 1.11 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.509 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -64.57 -14.9 47.11 Favored 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.64 2.227 . . . . 0.0 112.409 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.2 tt -53.18 -41.41 65.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.425 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 30.2 p-10 -48.79 -29.97 5.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.582 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -74.72 -47.86 29.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.684 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.1 mt -60.57 158.84 28.13 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.396 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -53.01 141.68 56.18 Favored 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 122.377 2.051 . . . . 0.0 112.082 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 18.6 mt . . . . . 0 C--O 1.22 -0.483 0 CA-C-O 118.038 -0.982 . . . . 0.0 110.518 179.922 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.514 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -72.75 152.8 53.39 Favored 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.58 2.186 . . . . 0.0 112.132 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.0 tp -56.76 144.41 8.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.581 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -59.45 157.66 10.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.587 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 69.4 m -63.26 145.83 54.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.553 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -90.55 21.41 3.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.841 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -75.79 131.94 40.09 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.78 0.324 . . . . 0.0 110.524 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.6 p -52.67 139.86 9.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.532 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -145.58 168.22 21.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.657 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -138.98 155.91 47.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.552 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.24 63.34 1.28 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.096 0.474 . . . . 0.0 110.567 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -56.4 149.7 16.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.513 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -57.43 96.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.498 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -120.86 -36.52 3.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.699 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 13.3 t -61.2 145.28 51.72 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.538 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.54 -18.95 55.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.508 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 93.4 m -65.13 -39.83 93.6 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.782 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 52.3 t -63.3 -48.87 76.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.665 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.18 -39.07 91.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.609 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.465 ' HA ' HD21 ' A' ' 23' ' ' LEU . 89.9 m -48.63 -41.41 31.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.235 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -80.13 -26.4 39.45 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.123 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -70.93 -55.06 9.22 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.603 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.465 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.5 pp -61.01 -31.38 71.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.6 -179.726 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.28 -41.58 89.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.71 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -62.83 -39.82 95.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.859 0.362 . . . . 0.0 110.625 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -65.01 -28.36 69.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.859 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -65.81 -61.78 1.87 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.73 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.2 m -68.52 -18.53 23.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.193 -179.392 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -85.48 -34.18 21.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.886 0.374 . . . . 0.0 110.526 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.6 t -96.39 19.05 12.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.161 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.1 t -57.99 -45.04 87.43 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.178 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -53.31 -55.14 27.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.117 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -57.48 -46.3 83.86 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.979 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -56.29 -54.74 41.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.692 0.282 . . . . 0.0 111.395 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.23 -35.97 92.26 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 111.246 -0.741 . . . . 0.0 111.246 -179.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.29 -40.52 96.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.801 0.334 . . . . 0.0 110.628 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 76.1 mt -68.85 -43.3 82.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.128 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.413 ' O ' HG22 ' A' ' 41' ' ' THR . 65.4 tp -67.55 -42.8 82.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.972 0.415 . . . . 0.0 110.296 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.0 m -62.05 -25.47 67.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.661 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.5 m -92.04 29.91 1.52 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.821 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.413 HG22 ' O ' ' A' ' 38' ' ' LEU . 14.9 t -92.48 30.29 1.54 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.58 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 50.8 p-10 -89.93 20.98 3.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.931 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.7 p -88.7 17.8 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.818 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 144.49 -23.34 2.02 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.049 -0.82 . . . . 0.0 111.049 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 37.8 m -98.2 33.9 2.08 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.803 0.335 . . . . 0.0 110.548 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.0 p-10 -62.19 -12.9 22.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.19 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.2 m -91.43 28.49 1.68 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.75 0.309 . . . . 0.0 110.76 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.3 p90 -95.39 19.93 10.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.795 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -53.58 137.97 37.95 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -70.24 -25.07 63.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.748 0.308 . . . . 0.0 110.679 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -60.3 -20.34 58.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.906 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 35.7 t30 -64.15 -26.71 68.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.783 0.325 . . . . 0.0 110.659 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.45 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -52.84 -39.57 62.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.738 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.25 -29.72 17.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.426 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -62.06 -51.22 68.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.594 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.416 HG13 ' N ' ' A' ' 57' ' ' LEU . 8.8 p -66.84 -40.37 85.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.82 0.343 . . . . 0.0 110.584 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.45 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.5 OUTLIER -50.09 -56.06 12.4 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.838 -179.882 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm -64.0 -27.81 69.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.807 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -64.46 -38.7 91.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.776 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -114.53 75.04 3.32 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.207 0.527 . . . . 0.0 110.388 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -68.48 -17.78 43.66 Favored 'Trans proline' 0 N--CA 1.495 1.577 0 C-N-CA 122.781 2.321 . . . . 0.0 112.553 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.2 tt -54.12 -42.69 69.75 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.775 0.322 . . . . 0.0 110.592 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -55.91 -33.52 64.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.519 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -74.83 -47.81 28.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.576 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.1 mt -70.9 159.51 85.22 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.414 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -52.88 140.17 58.64 Favored 'Trans proline' 0 N--CA 1.494 1.537 0 C-N-CA 122.456 2.104 . . . . 0.0 112.076 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.22 -0.478 0 CA-C-O 117.98 -1.009 . . . . 0.0 110.574 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.97 154.65 53.08 Favored 'Trans proline' 0 C--N 1.308 -1.555 0 C-N-CA 122.605 2.203 . . . . 0.0 112.126 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.5 tp -61.66 147.21 11.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.571 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -60.25 144.51 50.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.573 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.0 p -70.71 162.51 28.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.656 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.7 p80 -63.16 -23.08 67.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.732 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -54.37 135.11 45.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.578 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.3 p -134.74 144.16 35.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.583 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -140.06 175.83 9.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.614 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.84 162.25 32.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.616 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.2 150.55 36.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.564 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.401 ' HZ3' ' HB3' ' A' ' 14' ' ' ASN . 22.8 pttp -67.71 142.86 56.17 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.879 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.63 85.28 2.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.697 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.401 ' HB3' ' HZ3' ' A' ' 12' ' ' LYS . 14.2 p30 -102.6 -33.87 9.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.665 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.484 HG23 ' H ' ' A' ' 18' ' ' CYS . 2.6 t -46.57 145.34 1.87 Allowed 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.985 -179.685 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.85 -21.39 66.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.314 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 97.1 m -71.01 -40.36 71.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.895 0.379 . . . . 0.0 110.901 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.484 ' H ' HG23 ' A' ' 15' ' ' THR . 36.6 t -62.51 -47.61 83.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.683 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.65 -36.91 85.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.801 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.447 ' HA ' HD21 ' A' ' 23' ' ' LEU . 99.8 m -47.84 -45.39 29.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.35 -179.428 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -70.19 -27.97 64.92 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.862 -0.335 . . . . 0.0 111.061 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -74.29 -56.43 4.89 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.788 -0.365 . . . . 0.0 110.713 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.447 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.5 pp -64.61 -30.65 71.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.621 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.27 -46.82 88.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.487 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -61.47 -41.2 96.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.708 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -64.52 -35.61 81.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.651 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.491 ' C ' HD13 ' A' ' 27' ' ' LEU . 2.3 tm? -59.58 -53.42 58.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.118 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 32.6 m -71.06 -18.32 20.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.465 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -95.66 -12.41 25.6 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.562 -179.185 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.6 t -115.5 18.84 15.76 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 121.115 -0.234 . . . . 0.0 110.816 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.3 t -63.99 -46.61 83.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.265 0.555 . . . . 0.0 110.385 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -58.98 -59.13 5.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.88 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 28.1 m120 -59.68 -43.19 94.12 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.979 -179.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -52.6 -43.16 65.17 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.906 -0.317 . . . . 0.0 110.824 -179.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -59.87 -37.22 92.23 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.645 -0.982 . . . . 0.0 110.645 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.58 -43.5 93.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.721 0.296 . . . . 0.0 110.559 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 80.1 mt -69.31 -44.76 80.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.569 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 64.4 tp -55.98 -50.91 69.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.136 0.493 . . . . 0.0 109.884 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 68.9 m -47.44 -28.75 2.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.881 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 52.2 m -91.05 35.44 0.91 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.693 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.7 t -64.59 -11.25 32.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.16 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -82.1 9.08 9.2 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 120.979 -0.288 . . . . 0.0 111.283 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -89.45 19.22 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 120.954 -0.299 . . . . 0.0 110.812 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 119.23 -17.09 10.62 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 111.261 -0.736 . . . . 0.0 111.261 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 79.8 p -98.02 32.07 2.52 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.818 0.342 . . . . 0.0 110.61 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 49.6 p30 -95.24 25.44 4.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.732 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.64 28.55 1.98 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.518 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -112.71 21.31 15.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.865 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.32 132.02 25.34 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -71.06 -28.38 64.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.728 0.299 . . . . 0.0 110.608 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.4 ptt-85 -56.67 -18.36 12.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.951 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -72.14 -34.92 68.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.76 0.314 . . . . 0.0 110.551 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.458 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -59.88 -42.24 93.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.832 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.46 -29.91 48.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.485 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -71.26 -47.39 57.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.18 -179.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -73.39 -31.32 33.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.145 -179.322 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.458 HD13 ' O ' ' A' ' 53' ' ' ALA . 2.7 mp -64.06 -42.64 96.94 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.923 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -67.42 -39.27 85.47 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.412 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -61.42 -25.19 67.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.533 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -107.11 80.6 0.84 Allowed Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.508 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -63.16 -9.17 16.29 Favored 'Trans proline' 0 N--CA 1.495 1.581 0 C-N-CA 122.371 2.048 . . . . 0.0 112.692 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.4 tt -58.65 -42.29 88.04 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.321 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 39.5 p-10 -75.51 -12.23 60.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.037 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -74.57 -37.11 63.05 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.857 0.36 . . . . 0.0 110.489 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.2 mt -71.3 158.97 86.94 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.31 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -52.43 139.2 56.07 Favored 'Trans proline' 0 N--CA 1.494 1.508 0 C-N-CA 122.4 2.066 . . . . 0.0 112.063 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.947 -1.025 . . . . 0.0 110.582 -179.971 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.525 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -73.74 158.2 47.16 Favored 'Trans proline' 0 C--N 1.308 -1.553 0 C-N-CA 122.55 2.167 . . . . 0.0 112.253 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 tp -49.07 116.71 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.526 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.0 pt-20 -51.93 169.17 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.573 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 68.9 m -67.84 142.93 55.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.559 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 35.2 p80 -69.14 -20.25 64.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.891 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -54.77 132.15 45.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.775 0.321 . . . . 0.0 110.485 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.0 p -130.94 141.19 46.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.639 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -132.64 69.25 1.48 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.419 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -62.58 177.26 0.54 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.625 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.82 163.61 32.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.499 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -62.91 136.89 58.09 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.886 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.513 ' SG ' HG22 ' A' ' 15' ' ' THR . 20.2 t -69.14 79.04 0.34 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.695 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 47.2 p30 -87.46 -3.35 59.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.302 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.513 HG22 ' SG ' ' A' ' 13' ' ' CYS . 8.2 t -50.81 156.83 0.89 Allowed 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.835 0.35 . . . . 0.0 110.378 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.66 -34.89 65.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.87 -178.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 98.4 m -61.26 -50.21 73.97 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.947 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.435 ' H ' HG23 ' A' ' 15' ' ' THR . 60.6 m -68.08 -38.9 82.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.793 0.33 . . . . 0.0 110.564 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.17 -38.81 92.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.664 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.6 m -53.17 -47.39 68.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.462 -179.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -78.98 -27.01 43.37 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.71 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -64.18 -51.45 63.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.546 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.3 pp -72.62 -25.65 61.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.807 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.15 -52.5 58.54 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.635 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -69.07 -36.63 77.85 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.71 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -60.59 -36.25 78.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.608 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.498 ' C ' HD13 ' A' ' 27' ' ' LEU . 2.4 tm? -60.28 -51.7 68.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.021 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 27.7 m -76.04 -18.54 15.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.291 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -78.22 -41.64 33.76 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.756 0.313 . . . . 0.0 111.162 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.9 t -91.48 18.89 6.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.499 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.9 t -59.27 -50.31 74.49 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.323 -0.551 . . . . 0.0 109.964 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -48.95 -53.43 19.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.157 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -59.21 -44.73 92.26 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.606 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -51.81 -52.2 50.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.102 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -66.74 -35.63 90.02 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.347 -0.701 . . . . 0.0 111.347 -179.605 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.3 -41.25 98.94 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.704 0.288 . . . . 0.0 110.696 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.5 mt -72.42 -44.29 62.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.727 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.41 ' O ' HG22 ' A' ' 41' ' ' THR . 64.8 tp -60.62 -47.57 85.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.997 0.427 . . . . 0.0 110.226 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.4 t -50.04 -30.79 11.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.57 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.7 m -96.08 35.81 1.39 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.725 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.41 HG22 ' O ' ' A' ' 38' ' ' LEU . 13.4 t -91.43 34.17 0.97 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.717 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -91.75 20.79 5.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.811 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 5.4 p -101.54 4.84 10.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.785 0.326 . . . . 0.0 110.803 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 93.01 19.3 36.93 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.11 -0.796 . . . . 0.0 111.11 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 77.8 p -109.73 32.58 4.94 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.772 0.32 . . . . 0.0 110.597 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 46.2 p-10 -99.92 26.23 6.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.702 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.76 23.92 9.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.756 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 8.9 p90 -133.12 22.58 4.12 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.652 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -60.22 145.99 46.13 Favored Glycine 0 CA--C 1.524 0.603 0 N-CA-C 110.977 -0.849 . . . . 0.0 110.977 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -64.09 -36.0 82.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.778 0.323 . . . . 0.0 110.623 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.5 ptt-85 -59.75 -20.36 56.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.725 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.37 -23.63 66.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.627 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.446 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -56.51 -38.84 72.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.795 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -76.13 -32.61 23.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 120.819 -0.353 . . . . 0.0 110.444 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -64.63 -50.44 67.13 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.784 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.44 HG13 ' N ' ' A' ' 57' ' ' LEU . 7.5 p -64.09 -42.53 95.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.62 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.446 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.5 OUTLIER -47.94 -50.03 28.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.015 -179.836 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -61.28 -38.1 85.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.9 0.381 . . . . 0.0 110.522 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.8 tmt_? -65.65 -36.5 83.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.473 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -108.07 88.12 4.43 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.473 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -66.27 -5.65 13.04 Favored 'Trans proline' 0 N--CA 1.495 1.567 0 C-N-CA 122.144 1.896 . . . . 0.0 112.799 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.9 tp -60.94 -42.57 98.47 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.898 -0.321 . . . . 0.0 110.615 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -62.89 -17.34 61.53 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.937 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 55.8 t80 -74.56 -48.04 29.16 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.765 0.317 . . . . 0.0 110.321 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.1 mt -71.97 158.92 86.8 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.335 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -52.97 140.22 59.39 Favored 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 122.346 2.031 . . . . 0.0 112.052 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.539 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -73.82 165.87 31.13 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 122.514 2.143 . . . . 0.0 112.228 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.7 tp -60.08 144.58 12.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.63 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -71.23 168.84 16.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.513 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 82.7 p -67.7 162.61 23.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.585 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.5 p80 -91.15 23.15 3.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.768 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -65.92 135.82 55.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.583 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 7.0 p -137.77 146.55 27.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.516 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -143.45 162.24 36.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.603 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.5 pttt -135.24 149.95 49.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.498 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.18 178.62 7.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.641 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -80.75 148.6 30.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.51 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.57 92.79 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.697 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -114.02 -34.32 5.44 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.744 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -46.9 146.43 1.66 Allowed 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.083 -179.672 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.83 -20.96 66.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.05 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 97.8 m -69.43 -40.46 77.23 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.81 0.338 . . . . 0.0 110.733 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.6 t -60.59 -46.27 90.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.565 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.07 -29.35 69.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.803 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.5 m -61.49 -42.23 98.47 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.584 -179.273 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -74.52 -32.62 62.54 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.799 -178.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.84 -24.27 31.0 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.852 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 14.2 tp -77.86 -40.76 39.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.378 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.7 -45.69 91.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.795 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -63.81 -41.75 97.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.826 0.346 . . . . 0.0 110.624 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -71.2 -28.43 64.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.738 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.539 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -60.37 -62.08 2.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.08 -179.724 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.539 ' N ' HD13 ' A' ' 27' ' ' LEU . 21.3 m -67.8 -18.57 23.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.379 -179.639 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -88.58 -21.24 24.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.121 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.1 t -109.91 18.83 19.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.104 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 44.1 t -63.16 -52.46 62.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.053 0.454 . . . . 0.0 110.415 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -54.12 -57.65 10.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.837 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 29.2 m120 -58.96 -42.02 88.88 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.663 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -52.65 -41.79 64.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.18 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.8 -40.67 99.13 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.62 -42.32 87.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.724 0.297 . . . . 0.0 110.611 -179.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.4 mt -70.45 -45.73 73.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.574 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 60.7 tp -55.45 -50.92 68.58 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.944 0.402 . . . . 0.0 110.278 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.5 m -56.89 -36.0 69.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.609 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 75.1 m -90.79 35.85 0.9 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.86 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.43 ' O ' HG23 ' A' ' 41' ' ' THR . 9.6 t -85.22 47.93 1.49 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.858 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 16.4 p-10 -92.41 23.42 3.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.696 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.8 p -88.28 17.72 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.934 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.15 20.35 72.88 Favored Glycine 0 CA--C 1.53 0.974 0 N-CA-C 111.471 -0.651 . . . . 0.0 111.471 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 78.0 p -109.05 31.2 5.88 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.846 0.355 . . . . 0.0 110.359 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 19.8 p-10 -95.79 27.07 3.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.583 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.1 m -68.44 -14.09 62.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.695 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -90.32 20.72 4.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.618 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.19 144.84 7.77 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -62.37 -38.43 89.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.742 0.306 . . . . 0.0 110.509 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 34.8 ptt-85 -62.34 -14.18 36.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.142 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.44 -32.09 42.66 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.541 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.475 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -59.04 -44.6 91.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.803 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -70.2 -29.12 38.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.591 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -65.9 -46.56 77.87 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 121.007 -0.277 . . . . 0.0 110.85 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.5 p -76.62 -33.83 22.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.742 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.475 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -53.18 -50.82 63.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.889 179.935 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -68.61 -38.97 81.01 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.694 -0.403 . . . . 0.0 110.513 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.5 tmt_? -66.37 -22.24 66.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.677 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -108.26 82.59 1.61 Allowed Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.567 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -66.34 -5.96 13.84 Favored 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.375 2.05 . . . . 0.0 112.546 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 61.8 tp -62.74 -42.58 99.73 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -84.52 -8.02 59.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.986 179.377 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -74.85 -28.59 60.74 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-O 120.879 0.371 . . . . 0.0 110.525 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.8 mt -85.59 158.85 56.55 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.177 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -52.9 140.18 58.77 Favored 'Trans proline' 0 N--CA 1.493 1.492 0 C-N-CA 122.357 2.038 . . . . 0.0 112.066 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 117.96 -1.019 . . . . 0.0 110.562 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.46 155.81 54.9 Favored 'Trans proline' 0 N--CA 1.492 1.422 0 C-N-CA 122.32 2.014 . . . . 0.0 112.095 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.7 tp -50.46 141.07 3.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.546 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.1 pt-20 -56.02 164.8 1.12 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.587 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.2 p -69.9 161.55 29.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.652 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 33.1 p80 -64.03 -22.22 66.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.881 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -55.96 132.67 50.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.848 0.356 . . . . 0.0 110.539 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.3 p -58.2 150.92 4.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.606 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -147.62 165.57 30.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.595 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.5 pttt -138.98 147.83 42.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.602 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.42 63.51 1.27 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.592 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -60.07 147.32 39.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.636 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -73.63 86.32 1.63 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.7 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -104.43 -49.41 3.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.794 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.4 t -45.27 154.78 0.15 Allowed 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.013 0.435 . . . . 0.0 111.315 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.53 -18.27 62.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.288 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 99.1 m -63.39 -42.12 98.8 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.762 0.315 . . . . 0.0 110.775 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.6 t -61.85 -44.98 95.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.598 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.51 -34.18 72.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.89 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 78.7 m -62.18 -44.33 96.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.514 -179.292 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -72.67 -32.49 65.85 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.611 -178.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.12 -23.55 30.66 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.851 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 53.8 tp -84.01 -42.08 16.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.639 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.402 ' O ' HG13 ' A' ' 28' ' ' VAL . . . -60.0 -44.49 94.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.96 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.8 m120 -63.5 -38.64 91.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.874 0.369 . . . . 0.0 111.111 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -70.31 -38.7 75.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.078 -179.546 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.503 ' C ' HD13 ' A' ' 27' ' ' LEU . 2.6 tm? -66.32 -51.09 60.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.787 -179.207 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.402 HG13 ' O ' ' A' ' 24' ' ' ALA . 30.9 m -58.87 -21.72 19.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.247 -179.4 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -97.1 -24.67 15.64 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.939 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 73.2 m -95.03 18.82 11.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.171 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.9 t -59.91 -48.44 81.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.226 0.536 . . . . 0.0 109.786 179.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -50.89 -53.14 35.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.456 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -61.76 -40.08 93.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.029 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -51.55 -40.44 59.7 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.721 -0.391 . . . . 0.0 110.569 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -59.81 -40.1 96.25 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.51 -43.47 89.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.723 0.297 . . . . 0.0 110.549 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 79.2 mt -69.87 -43.41 79.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.529 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 63.2 tp -56.94 -47.0 81.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.008 0.433 . . . . 0.0 110.151 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.0 m -48.21 -31.71 6.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.84 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 71.1 m -93.6 35.21 1.13 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.849 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.0 t -92.26 34.8 1.02 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.657 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -90.78 22.64 3.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.767 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 p -89.53 19.81 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.785 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 103.63 -13.32 53.93 Favored Glycine 0 CA--C 1.529 0.955 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 88.3 p -91.72 24.5 3.1 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.735 0.302 . . . . 0.0 110.686 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -97.8 26.59 5.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.589 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.49 24.94 2.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.719 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 30.5 p90 -116.34 22.74 12.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.72 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -59.86 155.89 29.25 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -61.6 -36.1 79.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.805 0.336 . . . . 0.0 110.624 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.3 ptt-85 -59.44 -14.91 14.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.146 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.8 t30 -79.98 -32.96 39.81 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.726 0.298 . . . . 0.0 110.571 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.463 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -57.81 -47.3 83.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.791 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 14.7 p -69.99 -31.13 46.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.67 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -64.4 -46.81 81.65 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.649 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 13.2 p -76.69 -31.93 20.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.96 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.463 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.8 OUTLIER -55.47 -48.63 74.23 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 121.005 -0.278 . . . . 0.0 110.901 -179.987 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -65.7 -38.56 89.56 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.3 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -63.84 -23.17 67.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.723 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -108.07 80.43 1.07 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.731 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -66.05 -6.48 14.58 Favored 'Trans proline' 0 N--CA 1.494 1.548 0 C-N-CA 122.456 2.104 . . . . 0.0 112.556 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.6 tt -57.18 -41.66 79.7 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.308 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 31.8 p-10 -70.6 -19.12 62.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.725 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -74.57 -38.44 62.68 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.621 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.6 mt -71.65 159.07 86.56 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.39 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -53.98 141.62 67.11 Favored 'Trans proline' 0 N--CA 1.494 1.509 0 C-N-CA 122.396 2.064 . . . . 0.0 112.065 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 mt . . . . . 0 C--O 1.22 -0.45 0 CA-C-O 117.982 -1.009 . . . . 0.0 110.565 179.955 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.13 156.43 46.96 Favored 'Trans proline' 0 C--N 1.309 -1.525 0 C-N-CA 122.623 2.215 . . . . 0.0 112.243 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.1 tp -49.57 143.04 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.556 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 -114.86 174.0 6.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.588 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.3 p -69.59 161.61 29.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.56 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.6 p-80 -107.46 28.06 8.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.543 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -58.83 133.36 55.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.573 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.0 p -136.14 141.95 40.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.597 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.45 59.4 1.1 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.545 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -61.03 160.34 10.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.521 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.24 165.32 28.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.768 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.1 ptpp? -75.84 149.8 37.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.568 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.8 m -74.6 69.09 1.7 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.728 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 48.0 p30 -112.05 30.78 6.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.456 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.3 t -142.03 151.89 42.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.434 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.6 -20.83 58.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.148 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 95.8 m -62.0 -39.23 91.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.753 0.311 . . . . 0.0 110.826 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 50.8 t -59.37 -49.59 77.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.619 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.75 -43.36 96.68 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.731 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 79.6 m -47.6 -42.43 23.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.458 -179.295 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -82.94 -26.24 31.58 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.141 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.25 -28.08 53.5 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.529 -0.469 . . . . 0.0 111.543 -179.046 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.6 pp -84.65 -32.69 23.52 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.636 179.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.0 -47.71 84.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.968 -179.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -64.91 -40.25 94.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.822 0.344 . . . . 0.0 111.032 -179.798 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -65.09 -37.79 88.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.96 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.487 ' C ' HD13 ' A' ' 27' ' ' LEU . 2.2 tm? -66.65 -57.77 6.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.577 -179.449 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.1 m -54.18 -21.27 5.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.203 -179.556 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -97.08 -28.35 14.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.837 0.351 . . . . 0.0 110.855 -179.558 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.2 t -97.79 19.45 13.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.126 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 44.1 t -49.9 -48.8 51.36 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.919 0.39 . . . . 0.0 110.117 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -48.04 -51.62 23.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.346 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -59.5 -43.06 93.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.522 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -55.46 -44.11 76.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.853 0.358 . . . . 0.0 110.378 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -62.26 -40.65 99.28 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.734 -0.946 . . . . 0.0 110.734 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.62 -44.78 95.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.675 0.274 . . . . 0.0 110.961 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 82.0 mt -69.99 -46.98 71.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.963 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.417 HD11 ' OH ' ' A' ' 48' ' ' TYR . 49.4 tp -59.23 -45.1 92.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.007 0.432 . . . . 0.0 110.439 -179.818 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 69.5 m -51.21 -25.63 5.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.859 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 68.4 m -91.53 33.09 1.02 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.745 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.7 t -91.98 34.11 1.03 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.646 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -92.73 24.89 3.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.702 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.4 ' O ' HG22 ' A' ' 43' ' ' VAL . 5.4 p -91.41 23.83 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.954 0.407 . . . . 0.0 110.556 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 88.29 20.85 47.32 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 80.7 p -121.5 25.75 9.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.783 0.325 . . . . 0.0 110.556 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.6 p-10 -98.08 26.6 5.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.644 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -90.98 26.31 2.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.843 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.417 ' OH ' HD11 ' A' ' 38' ' ' LEU . 48.7 p90 -123.91 21.09 9.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.714 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -65.45 159.25 45.26 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -63.91 -28.03 69.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.845 0.355 . . . . 0.0 110.575 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 34.9 ptt-85 -62.39 -14.2 37.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.124 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -82.7 -30.76 28.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.733 0.302 . . . . 0.0 110.698 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.456 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -58.89 -43.77 91.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.914 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.7 p -75.05 -29.74 22.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.772 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -61.63 -49.59 75.95 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.805 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.1 p -71.45 -37.68 65.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.677 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.456 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -48.83 -51.43 29.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.975 179.968 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 40.3 mmtm -65.98 -38.21 87.97 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.594 -0.443 . . . . 0.0 110.484 -179.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -67.94 -22.62 65.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.841 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -107.33 82.31 1.2 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.724 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -65.48 -6.81 14.38 Favored 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.354 2.036 . . . . 0.0 112.579 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.0 tt -57.48 -42.41 82.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.796 0.332 . . . . 0.0 110.2 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 34.8 p-10 -74.22 -15.26 61.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.836 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -74.7 -29.56 61.24 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.746 0.308 . . . . 0.0 110.615 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.3 mt -70.89 158.7 87.51 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.274 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -52.96 140.1 59.58 Favored 'Trans proline' 0 N--CA 1.493 1.487 0 C-N-CA 122.363 2.042 . . . . 0.0 112.094 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.562 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -73.89 156.12 48.16 Favored 'Trans proline' 0 C--N 1.309 -1.516 0 C-N-CA 122.615 2.21 . . . . 0.0 112.24 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.3 tp -51.4 147.45 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.603 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -62.96 155.14 28.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.687 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 80.2 p -79.14 167.97 20.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.617 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 31.9 p80 -67.56 -22.84 65.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.824 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -61.22 135.38 57.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.653 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.6 p -137.36 144.11 32.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.539 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.25 72.94 1.39 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.607 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.05 164.21 0.89 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.609 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.13 170.76 15.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.553 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.4 pttp -65.59 139.56 58.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.613 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.86 88.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.605 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 16.9 p30 -108.05 -28.84 9.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.912 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.513 HG23 ' H ' ' A' ' 18' ' ' CYS . 1.8 t -48.94 145.25 4.04 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.87 0.366 . . . . 0.0 110.669 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.73 -23.69 67.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.512 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 96.8 m -70.34 -43.88 69.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.796 0.332 . . . . 0.0 110.827 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.513 ' H ' HG23 ' A' ' 15' ' ' THR . 22.2 t -62.45 -44.35 96.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.458 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.13 -37.77 88.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.707 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.441 ' HA ' HD21 ' A' ' 23' ' ' LEU . 97.7 m -47.98 -43.45 29.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.199 -179.511 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -72.14 -26.63 62.18 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.825 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -73.52 -49.61 25.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.763 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.441 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.6 pp -73.05 -33.05 65.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.596 -179.795 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.26 -46.39 86.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.808 0.337 . . . . 0.0 110.368 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -60.7 -41.57 95.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.568 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -63.15 -38.65 92.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.736 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.54 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -54.65 -62.03 1.92 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.001 0.429 . . . . 0.0 110.048 -179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.54 ' N ' HD13 ' A' ' 27' ' ' LEU . 27.8 m -63.62 -18.75 22.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.177 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -86.41 -19.46 29.64 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.024 -179.712 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.4 t -85.7 19.07 2.58 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.344 -179.769 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.1 t -61.95 -38.24 87.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.173 0.511 . . . . 0.0 110.523 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 7.7 p-10 -72.9 -51.87 16.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.454 -0.793 . . . . 0.0 111.171 -179.406 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -61.14 -44.3 97.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.993 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -46.07 -57.13 4.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.67 -179.004 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -64.37 -36.34 93.07 Favored Glycine 0 CA--C 1.526 0.732 0 C-N-CA 120.866 -0.683 . . . . 0.0 111.528 -179.137 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.89 -40.83 96.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.636 0.255 . . . . 0.0 110.874 -179.774 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.0 mt -74.17 -42.74 51.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.769 0.319 . . . . 0.0 110.71 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 65.4 tp -59.46 -50.42 74.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.143 0.497 . . . . 0.0 110.056 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.3 m -50.15 -26.9 5.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.786 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.9 m -92.16 29.49 1.63 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.732 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.2 t -59.25 -18.78 40.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.939 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 45.5 p-10 -82.11 8.89 9.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.308 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -89.02 18.42 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-O 120.717 0.294 . . . . 0.0 110.823 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 124.83 -20.45 6.79 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 111.139 -0.784 . . . . 0.0 111.139 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 70.0 p -98.48 34.12 2.09 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.81 0.338 . . . . 0.0 110.57 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -82.84 10.18 8.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.311 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.5 m -92.9 28.48 2.07 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.82 0.343 . . . . 0.0 110.516 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 12.2 p90 -101.87 19.87 17.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.904 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.92 126.61 22.39 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -71.06 -25.79 62.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.783 0.325 . . . . 0.0 110.615 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.3 ptt-85 -68.08 -19.31 64.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.001 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.91 -30.83 62.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.742 0.305 . . . . 0.0 110.691 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.464 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -59.34 -40.45 86.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.072 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -71.9 -29.84 34.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.904 -179.633 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -61.13 -51.3 69.69 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.701 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.428 HG13 ' N ' ' A' ' 57' ' ' LEU . 9.1 p -70.53 -41.81 78.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.495 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.464 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -50.11 -50.73 47.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.895 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm -69.3 -28.1 65.97 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.463 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -61.03 -25.82 67.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.591 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -119.04 75.78 14.53 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.531 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -66.37 -7.36 17.37 Favored 'Trans proline' 0 C--N 1.308 -1.588 0 C-N-CA 122.554 2.17 . . . . 0.0 112.494 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.3 tt -66.76 -36.94 83.62 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.271 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -84.73 -24.51 28.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.557 179.611 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 94.2 t80 -84.82 -24.9 28.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.691 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 64.4 mt -86.75 159.7 51.64 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.365 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -53.09 141.0 59.22 Favored 'Trans proline' 0 N--CA 1.494 1.537 0 C-N-CA 122.392 2.061 . . . . 0.0 112.081 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 15.5 mt . . . . . 0 C--O 1.22 -0.477 0 CA-C-O 117.941 -1.028 . . . . 0.0 110.592 179.992 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -74.44 154.04 45.11 Favored 'Trans proline' 0 C--N 1.308 -1.577 0 C-N-CA 122.588 2.192 . . . . 0.0 112.211 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.7 tp -58.23 135.87 22.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.511 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -65.79 160.19 23.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.588 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 68.1 m -64.46 149.49 48.41 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.543 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.3 p80 -62.15 -24.8 67.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.727 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 54.5 tt0 -97.48 130.87 44.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.575 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.5 p -135.52 141.64 41.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.575 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -149.83 70.05 1.04 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.695 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 63.6 pttt -139.04 155.5 47.91 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.598 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 95.4 mtm-85 -73.3 145.84 45.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.626 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -75.28 142.64 43.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.634 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 52.9 m 31.8 74.3 0.05 Allowed 'General case' 0 N--CA 1.47 0.568 0 O-C-N 124.163 0.915 . . . . 0.0 112.224 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -103.6 30.44 5.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.659 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.8 t -148.84 147.85 29.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.686 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.61 -20.62 34.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.124 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 97.7 m -59.4 -40.08 85.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.772 0.32 . . . . 0.0 110.704 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 54.0 t -59.22 -44.3 92.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.662 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.36 -41.94 97.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.614 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 98.7 m -59.95 -45.85 91.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.745 -179.259 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -78.85 -29.83 44.84 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.779 -178.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.12 -22.65 33.31 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.185 -179.633 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 52.3 tp -83.6 -41.89 17.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.799 0.333 . . . . 0.0 110.54 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.45 -43.64 93.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.867 -179.593 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -63.06 -39.21 94.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.812 0.339 . . . . 0.0 111.0 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -66.03 -39.55 90.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.138 -179.566 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.504 ' C ' HD13 ' A' ' 27' ' ' LEU . 2.5 tm? -65.78 -52.16 53.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.772 -179.267 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.6 m -59.24 -21.74 20.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.186 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -96.01 -25.9 15.75 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.871 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.7 t -100.86 19.22 17.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.135 -179.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 41.7 t -53.21 -51.33 62.47 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.922 0.391 . . . . 0.0 110.114 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -47.93 -53.37 16.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.557 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -60.5 -40.76 92.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.661 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -55.88 -39.52 71.67 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.395 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -60.95 -40.9 99.06 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.52 -1.032 . . . . 0.0 110.52 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.78 -43.89 85.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.746 0.308 . . . . 0.0 110.746 -179.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.8 mt -67.98 -43.98 85.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.731 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.404 ' O ' HG22 ' A' ' 41' ' ' THR . 60.7 tp -58.73 -48.65 80.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.893 0.377 . . . . 0.0 110.425 -179.743 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 68.8 m -49.02 -32.12 8.79 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.747 -179.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.5 m -94.97 35.85 1.24 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.838 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.404 HG22 ' O ' ' A' ' 38' ' ' LEU . 13.8 t -91.67 33.19 1.03 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.734 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.8 p-10 -86.87 14.62 6.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.06 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.1 p -64.76 -22.72 31.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.755 0.312 . . . . 0.0 110.766 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 148.53 -17.82 1.29 Allowed Glycine 0 CA--C 1.528 0.855 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 84.9 p -92.45 26.89 2.44 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.739 0.304 . . . . 0.0 110.542 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -92.3 25.81 2.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.598 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.12 28.41 1.89 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.689 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -117.34 23.93 11.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.695 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -55.43 145.7 31.09 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.009 -0.837 . . . . 0.0 111.009 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.2 mtmm -62.78 -37.88 88.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.77 0.319 . . . . 0.0 110.717 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.3 ptt-85 -62.88 -17.34 61.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.112 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -74.03 -28.79 61.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.804 0.335 . . . . 0.0 110.705 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.467 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -58.71 -41.45 86.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.931 -179.745 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -73.04 -30.93 33.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.814 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -63.39 -50.75 68.65 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.643 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.412 HG13 ' N ' ' A' ' 57' ' ' LEU . 9.9 p -68.94 -39.19 79.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.601 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.467 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -53.26 -51.34 62.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.068 179.958 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -69.61 -35.47 75.3 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.532 -179.65 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.8 tmt_? -61.78 -28.92 69.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.658 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -113.4 75.16 2.29 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.75 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -68.35 -5.96 16.32 Favored 'Trans proline' 0 C--N 1.307 -1.63 0 C-N-CA 122.703 2.269 . . . . 0.0 112.548 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.7 tt -62.36 -41.09 98.33 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.896 0.379 . . . . 0.0 110.267 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -63.8 -32.87 74.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.253 179.679 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -74.9 -38.47 61.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.689 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.7 mt -68.34 159.1 82.5 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.436 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -53.79 143.37 59.34 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 122.424 2.083 . . . . 0.0 112.18 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 13.3 mt . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 117.982 -1.009 . . . . 0.0 110.569 179.915 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -71.7 153.1 59.49 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 C-N-CA 122.246 1.964 . . . . 0.0 112.189 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.6 tp -57.96 140.72 15.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.592 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -61.36 158.97 13.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.552 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.6 p -69.95 159.42 33.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.589 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.2 p80 -103.04 23.37 12.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.686 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 -66.04 133.87 51.69 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.481 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.7 p -130.48 138.58 53.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.58 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.66 66.56 1.26 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.519 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.91 142.46 9.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.511 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.21 170.94 15.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.665 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -58.79 140.25 55.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.717 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.1 m -72.51 84.98 1.13 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.665 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -99.23 -44.13 6.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.638 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.9 t -47.15 153.17 0.48 Allowed 'General case' 0 C--O 1.231 0.113 0 CA-C-O 120.892 0.377 . . . . 0.0 110.991 -179.687 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.95 -15.15 62.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.468 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 98.3 m -68.29 -44.48 75.4 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.832 0.349 . . . . 0.0 110.687 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 10.2 t -63.38 -43.09 98.58 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.348 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.07 -36.31 82.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.85 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.431 ' HA ' HD21 ' A' ' 23' ' ' LEU . 64.5 m -49.12 -43.87 41.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.208 -179.448 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -73.47 -26.53 60.95 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.786 -0.366 . . . . 0.0 111.139 -179.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -75.83 -39.82 55.99 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.91 -0.316 . . . . 0.0 111.017 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.431 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.4 pp -84.01 -30.45 26.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.6 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.69 -47.67 84.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.475 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.3 m-20 -64.21 -40.39 95.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.725 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -64.34 -36.84 85.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.724 -179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.528 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -53.29 -61.82 2.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.182 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.528 ' N ' HD13 ' A' ' 27' ' ' LEU . 27.1 m -64.42 -19.81 25.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.339 -179.768 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -95.39 -0.3 52.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.655 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.9 t -118.2 16.22 14.04 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.137 -0.225 . . . . 0.0 110.872 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.9 t -64.51 -44.55 90.56 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.223 0.535 . . . . 0.0 110.41 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -58.66 -59.63 5.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.893 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -60.51 -42.19 95.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.987 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -50.16 -43.93 52.43 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.939 -0.304 . . . . 0.0 110.932 -179.487 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -60.81 -37.82 94.27 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.21 -42.14 90.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.587 -0.307 . . . . 0.0 110.514 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.6 mt -69.09 -42.1 81.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.499 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 63.1 tp -58.89 -52.23 66.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.092 0.472 . . . . 0.0 109.922 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.3 t -51.67 -26.2 8.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.546 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.2 m -91.98 28.6 1.8 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.643 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.424 ' O ' HG23 ' A' ' 41' ' ' THR . 9.7 t -85.94 46.98 1.38 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.809 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 -90.66 21.43 4.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.833 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 p -90.16 20.5 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.718 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 85.14 20.99 56.4 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 61.3 p -119.64 29.41 7.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.773 0.321 . . . . 0.0 110.547 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -96.08 26.89 3.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.556 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.8 m -91.98 28.45 1.84 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.678 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.411 ' HE2' HG21 ' A' ' 41' ' ' THR . 41.2 p90 -113.98 22.64 13.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.708 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -64.6 160.44 40.8 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.049 -0.82 . . . . 0.0 111.049 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm -63.16 -31.43 72.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.822 0.344 . . . . 0.0 110.691 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.1 ptt-85 -57.96 -16.48 12.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.024 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -79.85 -26.62 40.32 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.688 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.467 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -59.73 -51.74 68.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.902 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 4.8 p -66.09 -30.29 49.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.563 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -64.67 -47.67 77.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.664 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.95 -29.56 15.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.994 -179.682 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.467 HD13 ' O ' ' A' ' 53' ' ' ALA . 1.5 mp -59.67 -44.25 93.66 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.876 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -66.79 -38.86 87.36 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.273 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -63.78 -25.21 68.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.345 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -108.67 80.48 1.23 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.368 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -65.08 -7.11 14.42 Favored 'Trans proline' 0 N--CA 1.494 1.556 0 C-N-CA 122.457 2.105 . . . . 0.0 112.771 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.0 tt -58.37 -41.04 83.88 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.377 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 -71.34 -13.9 62.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.917 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -74.53 -34.4 63.0 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.884 0.373 . . . . 0.0 110.404 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.1 mt -73.15 159.01 86.13 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.382 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -53.05 139.33 61.83 Favored 'Trans proline' 0 N--CA 1.493 1.48 0 C-N-CA 122.386 2.057 . . . . 0.0 112.056 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 C--O 1.22 -0.494 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.559 179.95 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -73.48 160.74 43.9 Favored 'Trans proline' 0 C--N 1.309 -1.527 0 C-N-CA 122.633 2.222 . . . . 0.0 112.272 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.5 tp -49.31 135.82 6.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.608 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -70.6 168.87 15.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.705 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.0 p -71.92 171.08 12.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.508 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.3 p80 -51.04 -28.1 9.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.499 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 41.9 tt0 -70.9 131.1 43.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.408 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.7 p -136.96 141.64 39.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.626 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.6 61.34 1.51 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.38 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -56.29 152.11 11.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.675 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.9 177.77 8.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.5 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -126.1 155.3 41.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.603 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 49.0 m 32.11 79.86 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 O-C-N 124.094 0.871 . . . . 0.0 112.186 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.462 HD21 ' C ' ' A' ' 14' ' ' ASN . 0.5 OUTLIER -103.51 30.47 4.97 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.49 179.957 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 10.6 t -146.03 149.64 34.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.684 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.91 -22.09 65.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.211 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 97.4 m -60.29 -39.2 86.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.927 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 50.4 t -58.94 -48.28 82.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.764 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.63 -43.65 98.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.726 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.3 m -48.58 -42.86 35.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.305 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -82.95 -26.35 31.46 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -179.232 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.48 -27.79 61.58 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.616 -0.434 . . . . 0.0 111.55 -179.046 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.4 pp -84.51 -29.24 26.14 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.701 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.1 -50.27 74.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.67 -179.656 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -63.59 -42.52 98.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.919 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -62.13 -39.15 91.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.946 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.517 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.9 tm? -66.56 -61.53 1.93 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.546 -179.489 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.517 ' N ' HD13 ' A' ' 27' ' ' LEU . 24.3 m -55.46 -20.97 8.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.294 -179.596 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -97.13 -21.85 17.09 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.225 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.2 t -97.19 19.1 13.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.28 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 41.5 t -55.42 -53.05 61.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.035 0.445 . . . . 0.0 109.848 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -48.01 -51.23 24.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.44 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -61.3 -40.13 93.01 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.841 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -53.47 -39.05 64.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.777 0.322 . . . . 0.0 110.637 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.98 -43.87 96.78 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 110.569 -1.012 . . . . 0.0 110.569 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.34 -43.14 92.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.711 0.291 . . . . 0.0 110.818 -179.662 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.5 mt -66.56 -47.59 83.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.879 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.404 ' O ' HG22 ' A' ' 41' ' ' THR . 63.3 tp -58.97 -45.64 90.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.897 0.379 . . . . 0.0 110.51 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 71.1 m -49.52 -29.77 7.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.729 -179.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 68.5 m -94.06 34.13 1.28 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.739 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.404 HG22 ' O ' ' A' ' 38' ' ' LEU . 14.5 t -92.6 31.18 1.39 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.617 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 43.3 p-10 -94.06 23.49 4.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.741 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 p -89.34 19.71 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.806 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 112.05 -18.61 23.69 Favored Glycine 0 CA--C 1.527 0.792 0 N-CA-C 111.192 -0.763 . . . . 0.0 111.192 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 87.3 p -92.06 24.9 3.06 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.809 0.337 . . . . 0.0 110.63 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 50.3 p-10 -96.58 26.89 4.14 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.652 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.4 m -87.94 19.51 3.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.068 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 12.9 p90 -116.71 22.44 12.69 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.799 0.333 . . . . 0.0 110.55 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -58.79 153.93 28.54 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -61.79 -36.23 80.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.792 0.329 . . . . 0.0 110.692 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.2 ptt-85 -59.91 -15.56 22.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.98 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -80.25 -35.0 36.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.756 0.312 . . . . 0.0 110.547 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.414 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -58.99 -44.64 91.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.762 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 14.5 p -71.84 -32.16 43.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.638 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -62.09 -50.7 70.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.678 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 11.2 p -72.03 -32.77 45.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.928 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.414 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -53.77 -45.61 70.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.92 179.945 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -67.91 -40.46 83.4 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.39 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -63.55 -24.42 67.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.623 179.829 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -108.0 79.5 0.91 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.432 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -64.6 -7.67 15.19 Favored 'Trans proline' 0 N--CA 1.494 1.528 0 C-N-CA 122.361 2.041 . . . . 0.0 112.584 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.5 tt -63.81 -42.52 97.67 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.159 179.62 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -82.53 -5.18 58.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.957 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -74.5 -35.12 63.21 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-O 120.823 0.344 . . . . 0.0 110.489 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.3 mt -88.49 159.18 47.53 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.292 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -53.49 140.43 64.39 Favored 'Trans proline' 0 N--CA 1.494 1.507 0 C-N-CA 122.319 2.013 . . . . 0.0 112.093 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.22 -0.463 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.588 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -74.09 155.25 47.48 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.612 2.208 . . . . 0.0 112.223 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.8 tp -52.51 136.82 12.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.531 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -68.77 156.9 37.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.595 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 82.8 p -69.87 159.69 33.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.53 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 31.7 p80 -109.63 22.27 15.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.777 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -71.56 132.08 44.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.542 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.4 p -78.12 133.84 29.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.645 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.11 65.63 1.15 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.494 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.08 160.02 1.1 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.632 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.93 149.33 35.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.542 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.461 ' HZ3' ' HB3' ' A' ' 14' ' ' ASN . 23.6 pttp -72.78 145.44 47.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.906 -179.655 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.15 94.2 0.88 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.685 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.461 ' HB3' ' HZ3' ' A' ' 12' ' ' LYS . 12.8 p30 -125.66 -40.41 2.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.892 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.2 t -53.52 152.1 5.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.929 0.395 . . . . 0.0 110.878 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.62 -19.72 64.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.356 -179.557 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 92.3 m -65.03 -37.16 86.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.82 0.343 . . . . 0.0 110.706 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.0 t -59.41 -45.56 91.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.655 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.78 -39.18 90.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.725 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.446 ' HA ' HD21 ' A' ' 23' ' ' LEU . 59.4 m -47.32 -43.58 22.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.385 -179.361 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -77.14 -26.91 53.65 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.804 -0.358 . . . . 0.0 111.043 -179.485 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.7 tpp85 -69.26 -50.11 50.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.761 0.315 . . . . 0.0 110.53 -179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.446 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.5 pp -70.59 -31.72 68.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.65 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.81 -48.81 77.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.533 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -66.88 -40.13 87.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.868 0.366 . . . . 0.0 110.535 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -62.37 -27.77 69.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.908 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.516 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.8 tm? -64.46 -61.89 1.94 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.872 0.368 . . . . 0.0 110.254 -179.749 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.516 ' N ' HD13 ' A' ' 27' ' ' LEU . 19.7 m -70.67 -18.51 21.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.367 -179.707 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -82.18 -38.02 25.25 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.843 0.354 . . . . 0.0 110.889 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.88 19.13 18.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.203 -179.536 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.7 t -55.78 -49.35 73.39 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.129 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -50.58 -54.4 22.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.132 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -56.56 -45.83 81.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.629 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -53.55 -53.34 53.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.746 0.308 . . . . 0.0 111.124 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -67.38 -33.87 83.36 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.204 -0.758 . . . . 0.0 111.204 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.29 -42.88 99.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.735 0.302 . . . . 0.0 110.793 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.4 mt -66.09 -44.49 91.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.951 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.3 tp -65.27 -42.49 93.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.95 0.405 . . . . 0.0 110.12 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.8 m -58.89 -36.88 75.38 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.577 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 67.9 m -91.64 35.76 0.95 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.667 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.413 HG21 ' CZ ' ' A' ' 48' ' ' TYR . 9.1 t -56.62 -17.73 9.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.038 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.1 p-10 -79.32 5.01 13.53 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.359 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.6 p -88.58 16.53 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.01 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 148.14 -27.69 1.4 Allowed Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 5.9 p -99.22 34.08 2.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.849 0.357 . . . . 0.0 110.44 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.8 p-10 -63.88 -10.72 22.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.383 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -90.7 28.05 1.62 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.782 0.325 . . . . 0.0 110.818 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.413 ' CZ ' HG21 ' A' ' 41' ' ' THR . 13.8 p90 -90.01 20.01 4.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.846 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -48.04 102.6 0.05 OUTLIER Glycine 0 CA--C 1.525 0.662 0 N-CA-C 111.141 -0.783 . . . . 0.0 111.141 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.9 mtmm -79.4 -20.12 48.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.718 0.294 . . . . 0.0 110.83 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.4 ptt-85 -58.73 -15.82 13.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.139 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -74.93 -24.97 58.58 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.765 0.317 . . . . 0.0 110.749 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.459 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -58.02 -44.47 87.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.073 -179.574 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 1.6 p -77.31 -30.38 17.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.728 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -65.26 -46.34 80.92 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.791 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.407 HG13 ' N ' ' A' ' 57' ' ' LEU . 13.6 p -71.67 -38.51 66.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 120.85 -0.34 . . . . 0.0 110.577 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.459 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -49.56 -54.71 16.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.791 -179.982 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -64.3 -31.69 73.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.698 -179.525 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -62.71 -37.51 86.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.659 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -115.65 76.61 5.73 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.618 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -67.4 -13.03 37.92 Favored 'Trans proline' 0 C--N 1.308 -1.581 0 C-N-CA 122.7 2.267 . . . . 0.0 112.48 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 25.5 tp -58.81 -42.69 89.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.774 0.321 . . . . 0.0 110.402 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -50.7 -35.66 32.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.495 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 91.3 t80 -75.51 -47.91 24.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.69 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.7 mt -72.18 159.28 85.84 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.373 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -53.77 141.08 66.42 Favored 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.355 2.036 . . . . 0.0 112.041 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.221 -0.443 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.58 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -74.31 152.94 45.11 Favored 'Trans proline' 0 C--N 1.309 -1.539 0 C-N-CA 122.554 2.169 . . . . 0.0 112.196 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.8 tp -63.46 140.85 18.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.576 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -60.18 142.14 54.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.562 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.3 p -71.98 160.77 31.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.565 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 33.0 p80 -63.82 -24.13 67.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.672 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -67.77 139.22 56.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.619 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 8.7 p -128.09 142.04 44.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.567 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.92 77.33 1.62 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.571 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.13 165.87 10.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.376 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.02 168.43 19.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.691 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -60.78 145.6 49.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.77 -179.771 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -69.7 84.55 0.46 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.59 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -108.52 -37.78 5.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.603 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.451 HG23 ' H ' ' A' ' 18' ' ' CYS . 14.8 t -49.88 150.96 1.99 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.342 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.14 -15.68 63.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.708 -179.283 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 95.5 m -69.34 -40.41 77.58 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.984 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.451 ' H ' HG23 ' A' ' 15' ' ' THR . 15.5 t -64.49 -49.25 72.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.831 -179.533 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.56 -40.76 96.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.916 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.424 ' HA ' HD23 ' A' ' 23' ' ' LEU . 9.1 m -48.91 -34.46 12.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.228 -179.396 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -80.44 -26.26 38.48 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.571 -179.226 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.8 -25.65 60.22 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.544 -0.462 . . . . 0.0 111.288 -179.196 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' A' ' 20' ' ' THR . 1.5 pp -84.36 -26.38 28.46 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.567 179.853 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.39 -51.37 69.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.827 0.346 . . . . 0.0 110.486 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -64.29 -40.3 95.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.667 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -63.92 -36.71 84.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.646 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.555 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -56.1 -62.46 1.69 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.149 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.555 ' N ' HD13 ' A' ' 27' ' ' LEU . 25.7 m -66.45 -19.21 25.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.311 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -84.98 -13.18 51.45 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.322 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.8 t -85.72 19.03 2.6 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 121.098 -0.241 . . . . 0.0 111.248 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.6 t -60.59 -37.37 81.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.961 0.41 . . . . 0.0 110.774 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.3 p-10 -81.79 -50.16 9.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.237 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.439 ' O ' HD12 ' A' ' 37' ' ' ILE . 28.0 m120 -59.04 -44.24 91.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.109 -179.636 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -45.25 -56.31 4.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.484 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.27 -31.4 80.6 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 111.007 -0.837 . . . . 0.0 111.007 -179.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.27 -42.72 96.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.665 0.269 . . . . 0.0 110.674 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.439 HD12 ' O ' ' A' ' 33' ' ' ASN . 1.6 mp -70.2 -44.07 78.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.69 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.425 HD11 ' OH ' ' A' ' 48' ' ' TYR . 62.9 tp -60.81 -50.55 73.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.277 0.561 . . . . 0.0 109.833 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 71.2 m -48.9 -29.21 4.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.638 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.411 ' O ' HG12 ' A' ' 43' ' ' VAL . 56.3 m -90.97 36.0 0.91 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.75 -179.876 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.8 t -56.27 -21.69 25.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.901 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.0 p-10 -83.2 9.83 9.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.313 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.411 HG12 ' O ' ' A' ' 40' ' ' SER . 6.6 p -84.93 -21.57 7.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.761 0.315 . . . . 0.0 110.677 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 129.4 22.69 1.18 Allowed Glycine 0 CA--C 1.528 0.85 0 N-CA-C 111.079 -0.809 . . . . 0.0 111.079 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 84.5 p -124.59 33.91 5.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.844 0.354 . . . . 0.0 110.417 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 48.9 p30 -92.13 26.84 2.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.759 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.7 m -91.3 27.61 1.88 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.836 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.425 ' OH ' HD11 ' A' ' 38' ' ' LEU . 35.5 p90 -126.07 25.65 6.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.629 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.1 123.92 12.21 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -65.92 -36.73 84.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.775 0.321 . . . . 0.0 110.701 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 7.1 ptp180 -63.1 -19.2 64.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.034 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -74.29 -29.79 61.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.802 0.334 . . . . 0.0 110.653 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.468 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -58.72 -41.48 86.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.032 -179.758 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -71.91 -29.84 34.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.856 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -60.77 -52.2 66.09 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.606 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.408 HG13 ' N ' ' A' ' 57' ' ' LEU . 10.3 p -70.17 -39.72 77.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.56 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.468 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -53.53 -46.3 70.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.91 179.876 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -66.82 -39.48 87.71 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.374 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -66.04 -24.79 66.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.505 179.689 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.417 ' O ' ' ND2' ' A' ' 63' ' ' ASN . 75.2 mm-40 -105.83 85.48 1.55 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.509 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -63.68 -8.19 14.76 Favored 'Trans proline' 0 N--CA 1.495 1.573 0 C-N-CA 122.25 1.967 . . . . 0.0 112.67 -179.858 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.4 tt -59.28 -42.38 91.11 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.24 179.584 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.417 ' ND2' ' O ' ' A' ' 60' ' ' GLU . 2.5 p30 -78.63 -10.43 59.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.008 179.794 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -74.43 -39.13 62.79 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.797 0.332 . . . . 0.0 110.543 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.3 mt -72.24 158.76 86.99 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.297 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -52.44 137.79 56.97 Favored 'Trans proline' 0 N--CA 1.494 1.503 0 C-N-CA 122.321 2.014 . . . . 0.0 112.036 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.9 mt . . . . . 0 C--O 1.22 -0.49 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.542 -179.987 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -74.28 153.34 45.53 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.542 2.161 . . . . 0.0 112.185 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.8 tp -64.37 141.12 18.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.546 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -59.97 144.17 49.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.633 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.1 p -72.07 163.39 27.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.642 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -102.35 23.66 11.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.699 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 54.2 tt0 -88.37 132.68 34.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.534 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.0 p -130.09 142.87 42.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.528 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.94 68.78 1.3 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.555 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -54.89 156.2 3.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.511 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.28 166.6 25.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.605 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.0 ptpp? -61.46 151.54 32.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.725 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.5 m -74.62 69.01 1.71 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.739 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 48.2 p30 -113.01 23.89 12.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.837 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.6 t -130.7 154.11 48.27 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.458 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.04 -19.89 55.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.259 -179.514 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 98.1 m -63.21 -41.68 99.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.754 0.311 . . . . 0.0 110.896 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 44.1 t -60.35 -45.45 93.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.609 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.4 -40.62 97.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.729 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.458 ' HA ' HD21 ' A' ' 23' ' ' LEU . 84.8 m -45.79 -42.76 12.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.454 -179.36 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -82.1 -26.63 33.42 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.953 -179.605 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.5 tpp85 -66.97 -49.65 64.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.749 0.309 . . . . 0.0 110.708 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.458 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.6 pp -64.56 -32.64 74.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.499 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.66 -44.36 90.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.492 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -64.39 -40.79 96.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.937 0.399 . . . . 0.0 110.529 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -62.04 -33.68 74.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.903 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.533 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -58.88 -62.09 2.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.118 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.533 ' N ' HD13 ' A' ' 27' ' ' LEU . 29.2 m -64.48 -18.42 23.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.357 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -86.44 -28.32 23.58 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.023 -179.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.2 t -96.49 19.21 12.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.244 -179.486 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 40.4 t -55.53 -56.72 17.03 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.283 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -49.15 -50.18 38.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.408 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 28.3 m120 -58.24 -43.6 87.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.738 179.767 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -53.79 -50.07 66.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.724 0.297 . . . . 0.0 110.94 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -64.79 -39.44 96.61 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.88 -43.17 98.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.743 0.306 . . . . 0.0 110.802 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 80.1 mt -69.34 -44.54 80.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.883 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 62.1 tp -61.0 -44.17 97.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.985 0.421 . . . . 0.0 110.181 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.5 m -53.48 -34.78 59.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.607 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.1 m -91.08 35.71 0.91 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.675 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.8 t -57.3 -17.49 12.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.006 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 33.4 p-10 -53.86 -22.15 9.19 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.697 0.284 . . . . 0.0 110.784 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 9.8 p -52.55 -24.1 5.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.68 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 130.58 26.89 0.77 Allowed Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 78.9 p -122.77 28.65 7.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.743 0.306 . . . . 0.0 110.499 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 -93.15 21.63 5.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.807 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.0 m -92.98 28.55 2.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.818 0.342 . . . . 0.0 110.566 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 19.7 p90 -122.33 24.61 9.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.623 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.1 119.2 5.85 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -70.72 -25.46 62.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.765 0.317 . . . . 0.0 110.666 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -67.11 -18.67 65.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.015 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.25 -25.48 55.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.811 0.339 . . . . 0.0 110.702 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.37 -39.89 88.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.969 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -78.18 -30.14 15.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.639 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -62.77 -49.91 73.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.712 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.426 HG13 ' N ' ' A' ' 57' ' ' LEU . 8.8 p -66.82 -40.92 86.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.592 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.426 ' N ' HG13 ' A' ' 56' ' ' VAL . 0.4 OUTLIER -52.91 -51.89 59.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.96 -179.943 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -63.57 -22.21 66.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.831 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -67.28 -34.79 78.16 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.78 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -123.98 75.05 57.92 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.67 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -68.49 -19.92 42.23 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 122.737 2.292 . . . . 0.0 112.3 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.4 tt -60.89 -42.83 98.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.596 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -66.15 -32.81 74.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.747 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -74.73 -41.46 60.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.788 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.9 mt -64.64 159.23 62.93 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.426 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -53.43 141.38 61.73 Favored 'Trans proline' 0 N--CA 1.494 1.515 0 C-N-CA 122.417 2.078 . . . . 0.0 112.052 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.22 -0.496 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.556 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -72.95 159.12 48.72 Favored 'Trans proline' 0 C--N 1.309 -1.547 0 C-N-CA 122.561 2.174 . . . . 0.0 112.244 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.421 HG23 ' O ' ' A' ' 3' ' ' ILE . 8.8 tp -49.42 131.5 7.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.552 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -78.97 173.38 12.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.606 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 70.2 m -61.79 151.03 35.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.531 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.5 p80 -60.78 -25.39 66.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.632 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -89.68 88.41 7.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.56 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.0 p -139.56 146.05 25.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.512 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.05 157.82 45.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.685 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 26.1 pttm -139.16 159.75 41.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.573 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -119.34 133.15 55.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.451 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.1 pttp -64.96 138.66 58.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.54 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 11.9 m 32.07 80.05 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 O-C-N 124.082 0.864 . . . . 0.0 112.059 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.2 p30 -105.7 30.63 5.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.598 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.5 t -143.09 147.79 35.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.751 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.6 -26.61 65.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.161 -179.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 95.1 m -58.01 -38.68 76.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.98 -179.499 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 48.3 t -59.82 -45.04 93.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.862 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.68 -44.4 93.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.651 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 96.9 m -56.06 -43.99 78.47 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.19 -179.484 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -73.94 -56.14 5.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.722 -179.145 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.43 -27.58 64.45 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.348 -179.225 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.3 tp -71.52 -47.94 52.05 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.814 -0.355 . . . . 0.0 110.462 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.88 -42.27 93.37 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.95 -179.536 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -63.91 -39.36 93.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.838 0.351 . . . . 0.0 110.949 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -71.88 -36.44 70.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.959 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.485 ' C ' HD13 ' A' ' 27' ' ' LEU . 2.0 tm? -63.98 -59.44 4.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.55 -179.422 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.454 ' N ' HD13 ' A' ' 27' ' ' LEU . 35.8 m -51.08 -22.99 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.396 -179.505 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -94.75 -30.6 14.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.819 0.342 . . . . 0.0 110.896 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.4 t -99.31 19.51 15.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.192 -179.737 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.7 t -49.48 -50.38 41.59 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.778 0.323 . . . . 0.0 110.316 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 -46.93 -52.08 15.39 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.462 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.8 m-20 -56.98 -44.92 83.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.386 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -57.01 -45.69 82.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.823 0.344 . . . . 0.0 110.431 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -62.04 -49.69 72.82 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.41 -42.07 81.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.719 0.295 . . . . 0.0 110.908 -179.514 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 77.3 mt -63.87 -48.57 85.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.952 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.1 tp -62.97 -39.07 93.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.785 0.326 . . . . 0.0 110.555 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.2 t -49.58 -31.04 9.72 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.63 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 70.9 m -90.52 36.03 0.89 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.824 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.8 t -85.61 15.86 4.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.226 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -92.75 15.57 14.28 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.978 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.3 p -90.63 19.92 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 CA-C-O 120.785 0.326 . . . . 0.0 110.749 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 108.78 20.52 8.01 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 111.176 -0.769 . . . . 0.0 111.176 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 77.2 p -125.36 28.43 6.31 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.798 0.332 . . . . 0.0 110.479 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -94.37 22.07 6.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.855 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.4 m -93.65 26.26 3.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.627 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 20.1 p90 -118.8 22.43 11.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.803 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -48.94 108.0 0.36 Allowed Glycine 0 CA--C 1.525 0.66 0 N-CA-C 111.022 -0.831 . . . . 0.0 111.022 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -70.18 -27.25 64.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.79 0.329 . . . . 0.0 110.518 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -59.76 -18.69 45.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.933 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.98 -25.8 31.93 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.82 0.343 . . . . 0.0 110.583 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.457 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -61.41 -45.11 95.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.891 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 8.1 p -73.56 -30.61 30.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.6 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -64.26 -45.52 87.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.688 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 14.4 p -75.79 -31.73 23.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.722 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.457 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -61.58 -39.71 92.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.795 0.331 . . . . 0.0 110.626 179.768 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -62.2 -44.67 96.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.717 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -69.48 -38.47 77.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.648 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -76.1 157.31 83.41 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.449 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.46 -4.97 16.25 Favored 'Trans proline' 0 N--CA 1.493 1.492 0 C-N-CA 122.529 2.152 . . . . 0.0 112.692 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.5 tt -55.62 -42.43 74.9 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.862 0.363 . . . . 0.0 110.324 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 11.4 p-10 -77.75 -23.74 49.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.571 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -74.57 -35.4 63.03 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.689 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.2 mt -73.89 159.03 85.16 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.357 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -53.34 140.43 62.82 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 122.367 2.044 . . . . 0.0 112.053 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.22 -0.462 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.56 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -72.78 159.03 49.34 Favored 'Trans proline' 0 C--N 1.308 -1.58 0 C-N-CA 122.55 2.167 . . . . 0.0 112.153 -179.778 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.5 tp -49.58 140.29 3.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.548 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.0 pt-20 -57.04 175.64 0.13 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.655 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 66.4 m -63.31 162.78 11.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.601 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 17.5 p80 -68.61 -13.82 62.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.006 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.01 132.85 53.39 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.775 0.321 . . . . 0.0 110.363 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.2 p -122.78 146.22 28.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.659 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -147.14 162.25 39.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.539 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.2 pttt -130.61 152.03 50.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.584 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.27 163.43 34.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.521 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.6 ptpp? -82.5 134.37 35.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.541 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -53.27 95.15 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.056 -179.731 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -112.83 -36.12 5.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.017 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.471 HG23 ' H ' ' A' ' 18' ' ' CYS . 2.4 t -45.92 145.28 1.53 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.965 0.412 . . . . 0.0 111.096 -179.514 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.94 -21.25 66.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.169 -179.623 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 95.9 m -69.5 -40.86 76.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.815 0.34 . . . . 0.0 110.742 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.471 ' H ' HG23 ' A' ' 15' ' ' THR . 20.4 t -61.57 -46.7 88.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.647 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.31 -36.55 84.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.818 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.5 m -47.77 -41.88 24.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.09 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -76.22 -26.57 56.2 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.765 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -71.61 -44.08 65.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.853 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.6 pp -78.61 -30.42 46.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.803 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.48 -49.98 75.39 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.264 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -63.9 -38.6 91.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.417 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -62.79 -34.72 77.86 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.822 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.533 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -57.84 -61.98 2.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.974 0.416 . . . . 0.0 110.107 -179.764 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.533 ' N ' HD13 ' A' ' 27' ' ' LEU . 34.2 m -67.6 -18.61 24.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.544 -179.54 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -87.61 -21.89 25.07 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.293 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.0 t -100.81 19.04 17.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.266 -179.413 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.2 t -62.36 -52.8 62.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.979 0.419 . . . . 0.0 110.618 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -54.41 -51.95 63.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.836 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -61.06 -42.88 99.31 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.767 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -48.9 -48.96 42.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.073 -179.545 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.4 -39.52 97.84 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 -179.374 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.36 -43.6 96.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.657 0.265 . . . . 0.0 111.1 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.3 mt -74.59 -43.72 47.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.031 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 65.7 tp -58.93 -48.59 80.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.934 0.397 . . . . 0.0 110.491 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.7 m -48.95 -27.32 3.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.719 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.9 m -90.76 36.12 0.9 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.695 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 6.3 t -86.37 45.64 1.26 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.732 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 48.1 p-10 -98.61 21.16 11.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.708 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -88.45 15.9 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.78 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 100.91 8.94 47.06 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 59.4 p -109.39 26.22 10.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.786 0.327 . . . . 0.0 110.514 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -92.5 24.5 3.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.652 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.46 23.48 3.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.715 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 21.6 p90 -106.9 18.78 21.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.596 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -52.16 142.4 23.22 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -61.77 -38.64 88.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.757 0.313 . . . . 0.0 110.599 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.0 ptt-85 -67.26 -16.09 64.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.057 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.93 -27.02 36.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.794 0.331 . . . . 0.0 110.617 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.3 -43.17 92.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.908 -179.695 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.2 p -75.48 -29.71 21.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.695 -179.761 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.5 tm-20 -63.58 -47.54 81.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.69 0.281 . . . . 0.0 110.842 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.6 p -72.75 -37.56 55.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.597 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.61 -51.82 65.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.92 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -69.3 -26.79 64.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.883 0.373 . . . . 0.0 110.557 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -67.66 -31.45 71.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.81 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -123.07 74.2 48.51 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.761 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -69.16 -8.23 23.02 Favored 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.821 2.347 . . . . 0.0 112.616 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.3 tt -64.73 -42.59 95.1 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.858 0.361 . . . . 0.0 110.443 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -57.74 -32.05 67.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.533 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -80.13 -43.78 21.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.788 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 32.9 mt -72.43 159.04 86.41 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.364 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -52.72 139.22 58.88 Favored 'Trans proline' 0 N--CA 1.493 1.484 0 C-N-CA 122.399 2.066 . . . . 0.0 112.121 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.22 -0.46 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.548 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.856 0.36 . . . . 0.0 110.823 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 25.2 p30 -111.49 -17.63 13.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.064 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 13.2 t -87.87 150.23 23.64 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.823 0.344 . . . . 0.0 110.67 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.57 -17.74 56.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.286 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 96.2 m -63.68 -39.24 93.82 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 121.007 -0.277 . . . . 0.0 110.742 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 51.3 t -58.64 -50.71 72.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.724 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.51 -39.87 92.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.646 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.427 ' HA ' HD21 ' A' ' 23' ' ' LEU . 94.9 m -46.34 -42.74 15.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.551 -179.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -82.65 -26.89 31.74 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.13 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.5 tpp85 -67.74 -44.79 76.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.716 0.293 . . . . 0.0 110.959 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.427 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.5 pp -69.8 -32.04 70.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.813 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.47 -45.32 88.87 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.933 -0.307 . . . . 0.0 110.655 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 29.5 m120 -65.95 -39.34 90.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.968 0.413 . . . . 0.0 110.542 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -63.99 -33.51 75.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.852 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.549 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -55.33 -62.19 1.83 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.905 0.383 . . . . 0.0 110.236 -179.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.549 ' N ' HD13 ' A' ' 27' ' ' LEU . 31.7 m -62.09 -18.26 19.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.378 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -86.72 -28.4 23.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.025 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.41 19.08 19.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.313 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.0 t -53.55 -51.69 62.11 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.491 -0.484 . . . . 0.0 110.187 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -49.75 -53.89 22.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.202 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -56.77 -43.08 80.47 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.84 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -58.14 -51.1 71.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.709 0.29 . . . . 0.0 111.377 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.83 -44.69 91.57 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 120.974 -0.631 . . . . 0.0 111.527 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.48 -40.98 96.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.739 0.305 . . . . 0.0 110.987 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.2 mt -70.09 -45.19 77.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.066 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.41 HD11 ' CZ ' ' A' ' 48' ' ' TYR . 53.8 tp -64.79 -38.32 90.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.871 0.367 . . . . 0.0 110.471 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.6 m -55.07 -35.15 64.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.709 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 73.3 m -89.38 20.81 3.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.045 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.0 t -55.73 -21.72 20.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.807 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 45.0 p-10 -56.66 -18.04 10.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.974 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.0 p -53.4 -22.84 6.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.678 0.275 . . . . 0.0 110.807 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 148.52 -15.09 1.24 Allowed Glycine 0 CA--C 1.528 0.851 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 80.4 p -92.56 32.53 1.21 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.783 0.325 . . . . 0.0 110.593 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.2 p-10 -94.01 23.4 4.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.824 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.69 28.51 2.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.579 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.41 ' CZ ' HD11 ' A' ' 38' ' ' LEU . 17.7 p90 -118.04 24.35 11.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.684 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -48.18 105.44 0.12 Allowed Glycine 0 CA--C 1.526 0.729 0 N-CA-C 111.061 -0.815 . . . . 0.0 111.061 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -70.58 -24.87 62.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.755 0.312 . . . . 0.0 110.724 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.4 ptt-85 -61.74 -18.4 59.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.904 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -67.54 -24.96 65.6 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.825 0.345 . . . . 0.0 110.608 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.457 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -55.18 -38.77 68.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.702 -179.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.57 -30.62 17.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.492 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -63.59 -48.76 76.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.699 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.412 HG13 ' N ' ' A' ' 57' ' ' LEU . 9.0 p -67.81 -39.82 82.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.572 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.457 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -48.2 -56.0 9.03 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.985 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -63.27 -32.15 73.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.961 0.41 . . . . 0.0 110.5 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -66.96 -29.23 69.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.625 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -122.95 74.63 48.05 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.701 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -68.0 -11.15 31.13 Favored 'Trans proline' 0 C--N 1.307 -1.632 0 C-N-CA 122.821 2.347 . . . . 0.0 112.549 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.9 tt -58.78 -42.49 89.14 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.743 0.306 . . . . 0.0 110.487 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 18.3 p-10 -52.13 -31.31 30.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.551 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 93.5 t80 -80.45 -47.84 13.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.698 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.5 mt . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.387 -179.819 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.527 0.083 0 CA-C-O 120.753 0.311 . . . . 0.0 111.055 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -114.34 -40.36 3.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.904 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.463 HG23 ' H ' ' A' ' 18' ' ' CYS . 15.3 t -51.34 145.71 7.95 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.941 0.4 . . . . 0.0 110.552 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.93 -16.79 63.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.44 -179.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 93.4 m -68.18 -36.65 79.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.797 0.332 . . . . 0.0 110.663 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.463 ' H ' HG23 ' A' ' 15' ' ' THR . 45.5 t -59.95 -48.52 81.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.691 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.0 -33.87 74.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.609 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.8 m -62.08 -47.41 84.78 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.16 -179.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -74.3 -30.93 62.29 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.934 -0.307 . . . . 0.0 111.563 -179.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.32 -24.8 36.91 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.68 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.7 tp -75.36 -40.55 57.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.491 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.04 -50.06 74.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.802 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -63.96 -41.41 97.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.891 0.376 . . . . 0.0 110.796 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -67.61 -30.38 69.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.865 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.549 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -59.91 -62.14 2.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.927 0.394 . . . . 0.0 110.176 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.549 ' N ' HD13 ' A' ' 27' ' ' LEU . 28.2 m -65.23 -21.85 30.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.245 -179.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -84.51 -25.66 28.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.334 -179.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.8 t -100.47 18.97 17.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.257 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.3 t -60.31 -50.44 73.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.195 0.521 . . . . 0.0 110.258 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 14.5 p-10 -54.38 -48.74 71.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.437 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -62.55 -42.03 99.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.891 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -47.87 -50.07 27.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.654 0.264 . . . . 0.0 111.145 -179.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.38 -37.87 95.51 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.12 -44.05 97.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.616 0.245 . . . . 0.0 110.816 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.4 mt -71.8 -44.53 68.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.888 -0.325 . . . . 0.0 110.775 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 59.2 tp -59.37 -45.56 91.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.083 0.468 . . . . 0.0 110.024 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.6 m -51.86 -25.05 7.07 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.779 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.442 ' O ' HG12 ' A' ' 43' ' ' VAL . 69.5 m -91.14 25.35 2.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.76 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 15.3 t -56.73 -21.46 28.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.838 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -80.58 7.68 9.5 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.405 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.442 HG12 ' O ' ' A' ' 40' ' ' SER . 4.3 p -89.98 20.02 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-O 120.815 0.34 . . . . 0.0 110.76 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 115.7 -15.19 17.07 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 111.327 -0.709 . . . . 0.0 111.327 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 80.3 p -102.18 33.58 3.03 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.762 0.315 . . . . 0.0 110.616 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.3 p-10 -91.39 22.71 3.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.784 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.9 m -93.41 28.34 2.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.591 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -99.43 18.65 17.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.954 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.5 108.9 0.51 Allowed Glycine 0 CA--C 1.525 0.689 0 N-CA-C 111.029 -0.828 . . . . 0.0 111.029 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -72.6 -25.74 61.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.829 0.347 . . . . 0.0 110.705 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 34.8 ptt-85 -65.53 -15.09 62.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.11 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -82.34 -32.39 29.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.788 0.327 . . . . 0.0 110.575 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.51 -44.26 89.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.978 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.8 p -72.78 -28.57 27.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.766 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -57.52 -46.78 83.42 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.686 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -68.91 -32.53 54.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.464 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.9 mp -54.77 -54.31 43.76 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.951 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -69.48 -28.13 65.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.935 0.398 . . . . 0.0 110.623 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -65.82 -37.01 85.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.888 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -119.07 75.2 14.33 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.666 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -71.15 -7.08 20.61 Favored 'Trans proline' 0 C--N 1.305 -1.711 0 C-N-CA 122.656 2.237 . . . . 0.0 112.522 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 tt -66.8 -42.88 85.23 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.787 0.327 . . . . 0.0 110.626 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -67.02 -30.82 71.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.593 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -76.5 -44.36 35.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.58 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 90.2 mt . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.296 179.9 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.936 0.398 . . . . 0.0 110.696 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -110.74 -32.38 6.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.72 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.526 HG23 ' H ' ' A' ' 18' ' ' CYS . 2.4 t -47.96 145.14 3.15 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.939 0.399 . . . . 0.0 110.811 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.25 -21.97 66.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.204 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 92.8 m -70.85 -41.6 71.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.853 0.359 . . . . 0.0 110.746 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.526 ' H ' HG23 ' A' ' 15' ' ' THR . 50.9 t -62.08 -47.65 83.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.774 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.51 -36.07 81.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.915 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.43 ' HA ' HD21 ' A' ' 23' ' ' LEU . 91.5 m -49.44 -45.62 46.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.375 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -69.38 -27.81 65.63 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.876 -0.329 . . . . 0.0 111.248 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.5 tpp85 -74.65 -52.51 11.48 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.735 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.43 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.6 pp -68.96 -33.92 74.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.649 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.04 -46.6 85.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.73 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 31.3 m-20 -64.13 -39.95 95.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.867 0.365 . . . . 0.0 110.74 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -62.44 -31.62 72.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.773 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.532 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -64.1 -61.91 1.96 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.272 -179.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.532 ' N ' HD13 ' A' ' 27' ' ' LEU . 33.4 m -63.6 -18.45 22.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.629 -179.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -92.71 -26.9 17.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.259 -179.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.3 t -104.87 19.3 20.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.168 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 44.6 t -58.14 -51.2 70.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.027 0.442 . . . . 0.0 110.486 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -52.03 -51.85 54.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.551 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -60.7 -42.03 96.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.647 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -53.06 -48.61 67.55 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.001 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.02 -38.22 96.24 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 -179.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.22 -44.14 97.75 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.685 0.279 . . . . 0.0 110.804 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.9 mt -72.23 -46.36 58.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.977 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 61.1 tp -58.25 -45.89 86.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.02 0.438 . . . . 0.0 110.261 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.8 m -49.47 -27.72 4.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.832 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 71.2 m -91.92 31.66 1.22 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.7 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.4 t -67.22 -8.92 35.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.267 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.2 p-10 -82.56 9.53 9.17 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 120.917 -0.313 . . . . 0.0 111.299 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 p -89.48 19.7 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-O 120.812 0.339 . . . . 0.0 110.776 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 115.56 -17.12 16.35 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 111.235 -0.746 . . . . 0.0 111.235 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 81.7 p -94.74 29.71 2.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.832 0.349 . . . . 0.0 110.569 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -92.81 23.6 4.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.738 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.7 m -92.82 28.5 2.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.581 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -119.24 25.12 10.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.646 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -48.58 114.09 1.84 Allowed Glycine 0 CA--C 1.526 0.73 0 N-CA-C 111.091 -0.804 . . . . 0.0 111.091 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -66.89 -33.73 76.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.775 0.322 . . . . 0.0 110.662 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.3 ptt-85 -61.31 -16.24 43.77 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.051 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -82.59 -25.34 33.32 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.824 0.345 . . . . 0.0 110.654 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.452 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -59.87 -42.51 93.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.805 -179.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.3 p -77.8 -28.85 15.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.779 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -64.51 -45.98 84.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.661 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.0 p -73.61 -36.24 46.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.672 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.452 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -48.32 -49.92 32.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.043 179.984 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 40.3 mmtm -63.28 -40.32 97.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.921 0.391 . . . . 0.0 110.488 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -69.43 -21.96 63.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.791 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -114.92 74.59 3.53 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.626 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -67.52 -6.8 17.45 Favored 'Trans proline' 0 C--N 1.307 -1.625 0 C-N-CA 122.79 2.327 . . . . 0.0 112.473 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.4 tt -61.18 -42.15 98.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.729 0.3 . . . . 0.0 110.401 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 34.5 p-10 -54.67 -25.25 25.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.582 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -74.79 -47.56 30.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.505 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.0 mt . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.353 -179.958 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 49.1 m . . . . . 0 N--CA 1.47 0.538 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.0 p30 -106.63 30.63 5.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.602 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.2 t -148.87 150.55 33.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.594 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.53 -21.4 64.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.068 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 98.4 m -58.96 -38.48 79.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.783 0.325 . . . . 0.0 110.675 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 47.7 t -58.51 -44.54 89.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.716 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.57 -39.65 91.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.685 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 98.8 m -59.63 -48.67 80.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.577 -179.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -75.28 -30.96 60.58 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.717 -178.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.17 -22.98 38.53 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.897 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 63.3 tp -74.41 -45.17 48.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.601 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.82 -44.53 86.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.977 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.73 -41.69 98.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.789 0.328 . . . . 0.0 110.804 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -66.98 -36.68 82.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.811 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.538 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -58.68 -62.01 2.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.331 -179.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.538 ' N ' HD13 ' A' ' 27' ' ' LEU . 34.4 m -54.53 -19.48 3.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.482 -179.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -97.19 -18.92 18.97 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.267 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.5 t -104.44 19.39 20.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.053 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 41.8 t -54.15 -51.96 62.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.865 0.364 . . . . 0.0 110.382 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 -48.9 -52.23 25.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.411 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.7 m120 -60.14 -41.83 93.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.522 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -56.92 -49.45 75.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.774 0.321 . . . . 0.0 110.715 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.36 -41.63 99.38 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.889 -0.885 . . . . 0.0 110.889 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.75 -44.18 97.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.706 0.289 . . . . 0.0 111.049 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 80.7 mt -70.82 -45.97 70.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.167 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 57.7 tp -61.48 -43.72 98.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.869 0.366 . . . . 0.0 110.556 -179.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.7 m -52.32 -24.37 7.42 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.859 -179.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 72.4 m -90.79 35.85 0.9 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.783 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.0 t -85.68 48.82 1.65 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.673 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.4 p-10 -78.49 0.8 24.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.176 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 10.0 p -65.08 -25.47 37.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 CA-C-O 120.824 0.345 . . . . 0.0 110.671 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 117.86 22.61 3.88 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 111.126 -0.79 . . . . 0.0 111.126 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 78.8 p -110.32 28.23 8.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.794 0.33 . . . . 0.0 110.563 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 48.9 p-10 -95.93 26.45 4.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.575 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.2 m -91.4 24.48 2.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.771 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 41.7 p90 -120.3 24.27 10.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.601 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -55.91 147.3 30.08 Favored Glycine 0 CA--C 1.525 0.656 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -62.81 -37.2 85.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.702 0.287 . . . . 0.0 110.591 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.1 ptt-85 -66.13 -18.26 65.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.006 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -73.66 -25.34 60.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.749 0.309 . . . . 0.0 110.579 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.453 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -57.69 -40.63 79.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.778 -179.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -75.21 -30.67 23.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.608 -179.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -61.69 -49.01 78.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.724 0.297 . . . . 0.0 110.797 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.407 HG13 ' N ' ' A' ' 57' ' ' LEU . 10.3 p -70.78 -39.99 76.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.603 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.453 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.5 OUTLIER -48.46 -56.17 8.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.064 179.987 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -65.34 -33.91 77.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.974 0.416 . . . . 0.0 110.635 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -63.49 -35.24 79.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.822 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -114.19 75.17 3.05 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.789 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -68.02 -9.49 25.87 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 C-N-CA 122.752 2.301 . . . . 0.0 112.498 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.0 tt -60.23 -42.43 95.19 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.766 0.317 . . . . 0.0 110.394 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 24.0 p-10 -50.41 -29.9 11.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.484 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -74.69 -44.62 49.23 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.618 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.5 mt . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.288 -179.99 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.855 0.359 . . . . 0.0 110.654 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -120.09 -36.49 3.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.755 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.6 t -67.24 145.46 55.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.697 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.13 -17.58 28.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.215 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 96.0 m -63.23 -38.71 92.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.739 0.304 . . . . 0.0 110.688 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 52.4 t -59.15 -50.17 75.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.601 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.16 -39.09 89.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.664 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 97.5 m -47.94 -46.11 31.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.358 -179.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -68.72 -28.24 66.65 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.838 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.3 tpp85 -72.22 -44.28 63.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.878 0.37 . . . . 0.0 110.535 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 62.6 tp -57.93 -46.7 84.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.637 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.98 -45.84 71.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.74 -179.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -68.19 -40.55 82.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.908 0.385 . . . . 0.0 110.564 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -64.91 -27.35 68.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.926 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.516 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.8 tm? -61.34 -61.7 2.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.376 -179.592 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.516 ' N ' HD13 ' A' ' 27' ' ' LEU . 32.8 m -69.4 -18.38 22.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.478 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -80.63 -38.03 29.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.838 0.352 . . . . 0.0 110.74 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.9 t -94.67 18.82 10.88 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.237 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.7 t -58.84 -48.45 81.29 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.108 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -50.43 -56.4 11.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.074 179.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -56.74 -44.89 82.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.885 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -55.23 -54.5 42.59 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.705 0.288 . . . . 0.0 111.313 -179.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.69 -38.4 94.49 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 111.356 -0.697 . . . . 0.0 111.356 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.72 -40.7 95.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.807 0.337 . . . . 0.0 110.667 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.4 mt -68.2 -43.53 84.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.997 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 56.8 tp -65.42 -41.67 93.32 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.154 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.7 m -59.23 -35.22 73.26 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.501 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 52.5 m -91.56 35.39 0.95 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.673 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.9 t -56.72 -20.94 24.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.932 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 47.1 p-10 -56.21 -18.33 9.99 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.014 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.2 p -51.89 -25.18 5.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 120.731 0.301 . . . . 0.0 110.721 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 148.11 -14.48 1.3 Allowed Glycine 0 CA--C 1.528 0.864 0 N-CA-C 111.459 -0.656 . . . . 0.0 111.459 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 81.6 p -91.94 34.0 1.03 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.757 0.313 . . . . 0.0 110.68 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 44.7 p-10 -73.96 -0.81 17.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.375 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.5 m -92.13 28.12 1.98 Allowed 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.73 0.3 . . . . 0.0 110.606 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 13.0 p90 -98.53 19.27 14.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.924 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.59 102.64 0.06 OUTLIER Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm -80.18 -23.04 41.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.776 0.322 . . . . 0.0 110.661 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.1 ptt-85 -59.55 -19.01 45.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.946 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -62.61 -25.83 68.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.77 0.319 . . . . 0.0 110.608 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.459 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -54.73 -38.23 66.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.695 -179.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -76.83 -30.35 18.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.631 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -63.18 -51.01 68.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.665 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.407 HG13 ' N ' ' A' ' 57' ' ' LEU . 9.2 p -65.62 -39.27 84.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.502 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.459 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -47.74 -56.03 8.26 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.812 -179.843 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 40.5 mmtm -62.8 -35.34 79.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.935 0.398 . . . . 0.0 110.441 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.0 tmt_? -61.91 -37.49 84.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.601 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -110.66 76.11 1.11 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.509 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -64.57 -14.9 47.11 Favored 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.64 2.227 . . . . 0.0 112.409 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.2 tt -53.18 -41.41 65.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.425 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 30.2 p-10 -48.79 -29.97 5.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.582 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -74.72 -47.86 29.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.684 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.1 mt . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.396 -179.857 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.869 0.366 . . . . 0.0 110.498 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -120.86 -36.52 3.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.699 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 13.3 t -61.2 145.28 51.72 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.538 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.54 -18.95 55.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.508 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 93.4 m -65.13 -39.83 93.6 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.782 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 52.3 t -63.3 -48.87 76.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.665 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.18 -39.07 91.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.609 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.465 ' HA ' HD21 ' A' ' 23' ' ' LEU . 89.9 m -48.63 -41.41 31.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.235 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -80.13 -26.4 39.45 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.123 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -70.93 -55.06 9.22 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.603 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.465 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.5 pp -61.01 -31.38 71.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.6 -179.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.28 -41.58 89.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.71 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -62.83 -39.82 95.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.859 0.362 . . . . 0.0 110.625 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -65.01 -28.36 69.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.859 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -65.81 -61.78 1.87 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.73 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.2 m -68.52 -18.53 23.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.193 -179.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -85.48 -34.18 21.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.886 0.374 . . . . 0.0 110.526 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.6 t -96.39 19.05 12.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.161 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.1 t -57.99 -45.04 87.43 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.178 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -53.31 -55.14 27.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.117 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -57.48 -46.3 83.86 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.979 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -56.29 -54.74 41.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.692 0.282 . . . . 0.0 111.395 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.23 -35.97 92.26 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 111.246 -0.741 . . . . 0.0 111.246 -179.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.29 -40.52 96.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.801 0.334 . . . . 0.0 110.628 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 76.1 mt -68.85 -43.3 82.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.128 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.413 ' O ' HG22 ' A' ' 41' ' ' THR . 65.4 tp -67.55 -42.8 82.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.972 0.415 . . . . 0.0 110.296 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.0 m -62.05 -25.47 67.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.661 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.5 m -92.04 29.91 1.52 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.821 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.413 HG22 ' O ' ' A' ' 38' ' ' LEU . 14.9 t -92.48 30.29 1.54 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.58 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 50.8 p-10 -89.93 20.98 3.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.931 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.7 p -88.7 17.8 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.818 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 144.49 -23.34 2.02 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.049 -0.82 . . . . 0.0 111.049 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 37.8 m -98.2 33.9 2.08 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.803 0.335 . . . . 0.0 110.548 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.0 p-10 -62.19 -12.9 22.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.19 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.2 m -91.43 28.49 1.68 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.75 0.309 . . . . 0.0 110.76 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.3 p90 -95.39 19.93 10.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.795 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -53.58 137.97 37.95 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -70.24 -25.07 63.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.748 0.308 . . . . 0.0 110.679 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -60.3 -20.34 58.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.906 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 35.7 t30 -64.15 -26.71 68.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.783 0.325 . . . . 0.0 110.659 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.45 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -52.84 -39.57 62.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.738 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.25 -29.72 17.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.426 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -62.06 -51.22 68.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.594 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.416 HG13 ' N ' ' A' ' 57' ' ' LEU . 8.8 p -66.84 -40.37 85.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.82 0.343 . . . . 0.0 110.584 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.45 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.5 OUTLIER -50.09 -56.06 12.4 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.838 -179.882 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm -64.0 -27.81 69.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.807 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -64.46 -38.7 91.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.776 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -114.53 75.04 3.32 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.207 0.527 . . . . 0.0 110.388 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -68.48 -17.78 43.66 Favored 'Trans proline' 0 N--CA 1.495 1.577 0 C-N-CA 122.781 2.321 . . . . 0.0 112.553 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.2 tt -54.12 -42.69 69.75 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.775 0.322 . . . . 0.0 110.592 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -55.91 -33.52 64.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.519 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -74.83 -47.81 28.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.576 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.1 mt . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.414 179.993 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.96 0.409 . . . . 0.0 110.697 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -102.6 -33.87 9.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.665 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.484 HG23 ' H ' ' A' ' 18' ' ' CYS . 2.6 t -46.57 145.34 1.87 Allowed 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.985 -179.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.85 -21.39 66.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.314 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 97.1 m -71.01 -40.36 71.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.895 0.379 . . . . 0.0 110.901 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.484 ' H ' HG23 ' A' ' 15' ' ' THR . 36.6 t -62.51 -47.61 83.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.683 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.65 -36.91 85.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.801 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.447 ' HA ' HD21 ' A' ' 23' ' ' LEU . 99.8 m -47.84 -45.39 29.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.35 -179.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -70.19 -27.97 64.92 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.862 -0.335 . . . . 0.0 111.061 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -74.29 -56.43 4.89 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.788 -0.365 . . . . 0.0 110.713 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.447 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.5 pp -64.61 -30.65 71.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.621 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.27 -46.82 88.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.487 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -61.47 -41.2 96.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.708 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -64.52 -35.61 81.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.651 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.491 ' C ' HD13 ' A' ' 27' ' ' LEU . 2.3 tm? -59.58 -53.42 58.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.118 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 32.6 m -71.06 -18.32 20.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.465 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -95.66 -12.41 25.6 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.562 -179.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.6 t -115.5 18.84 15.76 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 121.115 -0.234 . . . . 0.0 110.816 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.3 t -63.99 -46.61 83.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.265 0.555 . . . . 0.0 110.385 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -58.98 -59.13 5.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.88 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 28.1 m120 -59.68 -43.19 94.12 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.979 -179.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -52.6 -43.16 65.17 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.906 -0.317 . . . . 0.0 110.824 -179.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -59.87 -37.22 92.23 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.645 -0.982 . . . . 0.0 110.645 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.58 -43.5 93.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.721 0.296 . . . . 0.0 110.559 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 80.1 mt -69.31 -44.76 80.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.569 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 64.4 tp -55.98 -50.91 69.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.136 0.493 . . . . 0.0 109.884 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 68.9 m -47.44 -28.75 2.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.881 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 52.2 m -91.05 35.44 0.91 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.693 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.7 t -64.59 -11.25 32.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.16 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -82.1 9.08 9.2 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 120.979 -0.288 . . . . 0.0 111.283 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -89.45 19.22 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 120.954 -0.299 . . . . 0.0 110.812 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 119.23 -17.09 10.62 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 111.261 -0.736 . . . . 0.0 111.261 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 79.8 p -98.02 32.07 2.52 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.818 0.342 . . . . 0.0 110.61 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 49.6 p30 -95.24 25.44 4.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.732 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.64 28.55 1.98 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.518 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -112.71 21.31 15.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.865 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.32 132.02 25.34 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -71.06 -28.38 64.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.728 0.299 . . . . 0.0 110.608 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.4 ptt-85 -56.67 -18.36 12.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.951 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -72.14 -34.92 68.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.76 0.314 . . . . 0.0 110.551 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.458 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -59.88 -42.24 93.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.832 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.46 -29.91 48.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.485 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -71.26 -47.39 57.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.18 -179.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -73.39 -31.32 33.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.145 -179.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.458 HD13 ' O ' ' A' ' 53' ' ' ALA . 2.7 mp -64.06 -42.64 96.94 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.923 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -67.42 -39.27 85.47 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.412 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -61.42 -25.19 67.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.533 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -107.11 80.6 0.84 Allowed Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.508 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -63.16 -9.17 16.29 Favored 'Trans proline' 0 N--CA 1.495 1.581 0 C-N-CA 122.371 2.048 . . . . 0.0 112.692 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.4 tt -58.65 -42.29 88.04 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.321 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 39.5 p-10 -75.51 -12.23 60.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.037 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -74.57 -37.11 63.05 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.857 0.36 . . . . 0.0 110.489 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.2 mt . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.31 -179.932 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.513 ' SG ' HG22 ' A' ' 15' ' ' THR . 20.2 t . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.734 0.302 . . . . 0.0 110.695 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 47.2 p30 -87.46 -3.35 59.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.302 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.513 HG22 ' SG ' ' A' ' 13' ' ' CYS . 8.2 t -50.81 156.83 0.89 Allowed 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.835 0.35 . . . . 0.0 110.378 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.66 -34.89 65.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.87 -178.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 98.4 m -61.26 -50.21 73.97 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.947 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.435 ' H ' HG23 ' A' ' 15' ' ' THR . 60.6 m -68.08 -38.9 82.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.793 0.33 . . . . 0.0 110.564 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.17 -38.81 92.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.664 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.6 m -53.17 -47.39 68.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.462 -179.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -78.98 -27.01 43.37 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.71 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -64.18 -51.45 63.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.546 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.3 pp -72.62 -25.65 61.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.807 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.15 -52.5 58.54 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.635 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -69.07 -36.63 77.85 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.71 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -60.59 -36.25 78.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.608 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.498 ' C ' HD13 ' A' ' 27' ' ' LEU . 2.4 tm? -60.28 -51.7 68.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.021 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 27.7 m -76.04 -18.54 15.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.291 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -78.22 -41.64 33.76 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.756 0.313 . . . . 0.0 111.162 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.9 t -91.48 18.89 6.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.499 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.9 t -59.27 -50.31 74.49 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.323 -0.551 . . . . 0.0 109.964 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -48.95 -53.43 19.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.157 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -59.21 -44.73 92.26 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.606 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -51.81 -52.2 50.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.102 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -66.74 -35.63 90.02 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.347 -0.701 . . . . 0.0 111.347 -179.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.3 -41.25 98.94 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.704 0.288 . . . . 0.0 110.696 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.5 mt -72.42 -44.29 62.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.727 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.41 ' O ' HG22 ' A' ' 41' ' ' THR . 64.8 tp -60.62 -47.57 85.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.997 0.427 . . . . 0.0 110.226 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.4 t -50.04 -30.79 11.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.57 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.7 m -96.08 35.81 1.39 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.725 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.41 HG22 ' O ' ' A' ' 38' ' ' LEU . 13.4 t -91.43 34.17 0.97 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.717 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -91.75 20.79 5.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.811 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 5.4 p -101.54 4.84 10.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.785 0.326 . . . . 0.0 110.803 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 93.01 19.3 36.93 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.11 -0.796 . . . . 0.0 111.11 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 77.8 p -109.73 32.58 4.94 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.772 0.32 . . . . 0.0 110.597 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 46.2 p-10 -99.92 26.23 6.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.702 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.76 23.92 9.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.756 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 8.9 p90 -133.12 22.58 4.12 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.652 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -60.22 145.99 46.13 Favored Glycine 0 CA--C 1.524 0.603 0 N-CA-C 110.977 -0.849 . . . . 0.0 110.977 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -64.09 -36.0 82.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.778 0.323 . . . . 0.0 110.623 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.5 ptt-85 -59.75 -20.36 56.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.725 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.37 -23.63 66.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.627 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.446 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -56.51 -38.84 72.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.795 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -76.13 -32.61 23.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 120.819 -0.353 . . . . 0.0 110.444 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -64.63 -50.44 67.13 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.784 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.44 HG13 ' N ' ' A' ' 57' ' ' LEU . 7.5 p -64.09 -42.53 95.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.62 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.446 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.5 OUTLIER -47.94 -50.03 28.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.015 -179.836 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -61.28 -38.1 85.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.9 0.381 . . . . 0.0 110.522 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.8 tmt_? -65.65 -36.5 83.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.473 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -108.07 88.12 4.43 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.473 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -66.27 -5.65 13.04 Favored 'Trans proline' 0 N--CA 1.495 1.567 0 C-N-CA 122.144 1.896 . . . . 0.0 112.799 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.9 tp -60.94 -42.57 98.47 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.898 -0.321 . . . . 0.0 110.615 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -62.89 -17.34 61.53 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.937 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 55.8 t80 -74.56 -48.04 29.16 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.765 0.317 . . . . 0.0 110.321 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.1 mt . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.335 -179.876 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.916 0.388 . . . . 0.0 110.697 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -114.02 -34.32 5.44 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.744 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -46.9 146.43 1.66 Allowed 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.083 -179.672 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.83 -20.96 66.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.05 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 97.8 m -69.43 -40.46 77.23 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.81 0.338 . . . . 0.0 110.733 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.6 t -60.59 -46.27 90.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.565 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.07 -29.35 69.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.803 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.5 m -61.49 -42.23 98.47 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.584 -179.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -74.52 -32.62 62.54 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.799 -178.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.84 -24.27 31.0 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.852 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 14.2 tp -77.86 -40.76 39.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.378 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.7 -45.69 91.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.795 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -63.81 -41.75 97.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.826 0.346 . . . . 0.0 110.624 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -71.2 -28.43 64.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.738 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.539 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -60.37 -62.08 2.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.08 -179.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.539 ' N ' HD13 ' A' ' 27' ' ' LEU . 21.3 m -67.8 -18.57 23.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.379 -179.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -88.58 -21.24 24.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.121 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.1 t -109.91 18.83 19.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.104 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 44.1 t -63.16 -52.46 62.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.053 0.454 . . . . 0.0 110.415 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -54.12 -57.65 10.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.837 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 29.2 m120 -58.96 -42.02 88.88 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.663 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -52.65 -41.79 64.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.18 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.8 -40.67 99.13 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.62 -42.32 87.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.724 0.297 . . . . 0.0 110.611 -179.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.4 mt -70.45 -45.73 73.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.574 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 60.7 tp -55.45 -50.92 68.58 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.944 0.402 . . . . 0.0 110.278 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.5 m -56.89 -36.0 69.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.609 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 75.1 m -90.79 35.85 0.9 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.86 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.43 HG23 ' O ' ' A' ' 41' ' ' THR . 9.6 t -85.22 47.93 1.49 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.858 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 16.4 p-10 -92.41 23.42 3.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.696 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.8 p -88.28 17.72 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.934 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.15 20.35 72.88 Favored Glycine 0 CA--C 1.53 0.974 0 N-CA-C 111.471 -0.651 . . . . 0.0 111.471 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 78.0 p -109.05 31.2 5.88 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.846 0.355 . . . . 0.0 110.359 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 19.8 p-10 -95.79 27.07 3.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.583 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.1 m -68.44 -14.09 62.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.695 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -90.32 20.72 4.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.618 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.19 144.84 7.77 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -62.37 -38.43 89.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.742 0.306 . . . . 0.0 110.509 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 34.8 ptt-85 -62.34 -14.18 36.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.142 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.44 -32.09 42.66 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.541 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.475 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -59.04 -44.6 91.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.803 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -70.2 -29.12 38.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.591 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -65.9 -46.56 77.87 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 121.007 -0.277 . . . . 0.0 110.85 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.5 p -76.62 -33.83 22.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.742 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.475 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -53.18 -50.82 63.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.889 179.935 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -68.61 -38.97 81.01 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.694 -0.403 . . . . 0.0 110.513 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.5 tmt_? -66.37 -22.24 66.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.677 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -108.26 82.59 1.61 Allowed Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.567 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -66.34 -5.96 13.84 Favored 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.375 2.05 . . . . 0.0 112.546 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 61.8 tp -62.74 -42.58 99.73 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -84.52 -8.02 59.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.986 179.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -74.85 -28.59 60.74 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-O 120.879 0.371 . . . . 0.0 110.525 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.8 mt . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.177 179.951 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.809 0.338 . . . . 0.0 110.7 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -104.43 -49.41 3.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.794 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.4 t -45.27 154.78 0.15 Allowed 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.013 0.435 . . . . 0.0 111.315 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.53 -18.27 62.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.288 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 99.1 m -63.39 -42.12 98.8 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.762 0.315 . . . . 0.0 110.775 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.6 t -61.85 -44.98 95.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.598 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.51 -34.18 72.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.89 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 78.7 m -62.18 -44.33 96.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.514 -179.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -72.67 -32.49 65.85 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.611 -178.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.12 -23.55 30.66 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.851 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 53.8 tp -84.01 -42.08 16.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.639 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.402 ' O ' HG13 ' A' ' 28' ' ' VAL . . . -60.0 -44.49 94.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.96 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.8 m120 -63.5 -38.64 91.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.874 0.369 . . . . 0.0 111.111 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -70.31 -38.7 75.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.078 -179.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.503 ' C ' HD13 ' A' ' 27' ' ' LEU . 2.6 tm? -66.32 -51.09 60.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.787 -179.207 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.402 HG13 ' O ' ' A' ' 24' ' ' ALA . 30.9 m -58.87 -21.72 19.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.247 -179.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -97.1 -24.67 15.64 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.939 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 73.2 m -95.03 18.82 11.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.171 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.9 t -59.91 -48.44 81.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.226 0.536 . . . . 0.0 109.786 179.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -50.89 -53.14 35.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.456 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -61.76 -40.08 93.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.029 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -51.55 -40.44 59.7 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.721 -0.391 . . . . 0.0 110.569 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -59.81 -40.1 96.25 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.51 -43.47 89.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.723 0.297 . . . . 0.0 110.549 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 79.2 mt -69.87 -43.41 79.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.529 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 63.2 tp -56.94 -47.0 81.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.008 0.433 . . . . 0.0 110.151 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.0 m -48.21 -31.71 6.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.84 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 71.1 m -93.6 35.21 1.13 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.849 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.0 t -92.26 34.8 1.02 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.657 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -90.78 22.64 3.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.767 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 p -89.53 19.81 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.785 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 103.63 -13.32 53.93 Favored Glycine 0 CA--C 1.529 0.955 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 88.3 p -91.72 24.5 3.1 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.735 0.302 . . . . 0.0 110.686 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -97.8 26.59 5.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.589 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.49 24.94 2.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.719 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 30.5 p90 -116.34 22.74 12.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.72 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -59.86 155.89 29.25 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -61.6 -36.1 79.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.805 0.336 . . . . 0.0 110.624 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.3 ptt-85 -59.44 -14.91 14.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.146 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.8 t30 -79.98 -32.96 39.81 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.726 0.298 . . . . 0.0 110.571 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.463 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -57.81 -47.3 83.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.791 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 14.7 p -69.99 -31.13 46.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.67 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -64.4 -46.81 81.65 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.649 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 13.2 p -76.69 -31.93 20.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.96 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.463 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.8 OUTLIER -55.47 -48.63 74.23 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 121.005 -0.278 . . . . 0.0 110.901 -179.987 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -65.7 -38.56 89.56 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.3 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -63.84 -23.17 67.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.723 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -108.07 80.43 1.07 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.731 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -66.05 -6.48 14.58 Favored 'Trans proline' 0 N--CA 1.494 1.548 0 C-N-CA 122.456 2.104 . . . . 0.0 112.556 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.6 tt -57.18 -41.66 79.7 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.308 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 31.8 p-10 -70.6 -19.12 62.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.725 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -74.57 -38.44 62.68 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.621 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.6 mt . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.39 -179.938 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.855 0.36 . . . . 0.0 110.728 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 48.0 p30 -112.05 30.78 6.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.456 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.3 t -142.03 151.89 42.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.434 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.6 -20.83 58.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.148 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 95.8 m -62.0 -39.23 91.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.753 0.311 . . . . 0.0 110.826 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 50.8 t -59.37 -49.59 77.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.619 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.75 -43.36 96.68 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.731 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 79.6 m -47.6 -42.43 23.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.458 -179.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -82.94 -26.24 31.58 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.25 -28.08 53.5 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.529 -0.469 . . . . 0.0 111.543 -179.046 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.6 pp -84.65 -32.69 23.52 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.636 179.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.0 -47.71 84.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.968 -179.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -64.91 -40.25 94.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.822 0.344 . . . . 0.0 111.032 -179.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -65.09 -37.79 88.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.96 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.487 ' C ' HD13 ' A' ' 27' ' ' LEU . 2.2 tm? -66.65 -57.77 6.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.577 -179.449 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.1 m -54.18 -21.27 5.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.203 -179.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -97.08 -28.35 14.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.837 0.351 . . . . 0.0 110.855 -179.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.2 t -97.79 19.45 13.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.126 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 44.1 t -49.9 -48.8 51.36 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.919 0.39 . . . . 0.0 110.117 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -48.04 -51.62 23.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.346 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -59.5 -43.06 93.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.522 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -55.46 -44.11 76.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.853 0.358 . . . . 0.0 110.378 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -62.26 -40.65 99.28 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.734 -0.946 . . . . 0.0 110.734 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.62 -44.78 95.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.675 0.274 . . . . 0.0 110.961 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 82.0 mt -69.99 -46.98 71.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.963 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.417 HD11 ' OH ' ' A' ' 48' ' ' TYR . 49.4 tp -59.23 -45.1 92.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.007 0.432 . . . . 0.0 110.439 -179.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 69.5 m -51.21 -25.63 5.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.859 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 68.4 m -91.53 33.09 1.02 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.745 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.7 t -91.98 34.11 1.03 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.646 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -92.73 24.89 3.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.702 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.4 ' O ' HG22 ' A' ' 43' ' ' VAL . 5.4 p -91.41 23.83 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.954 0.407 . . . . 0.0 110.556 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 88.29 20.85 47.32 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 80.7 p -121.5 25.75 9.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.783 0.325 . . . . 0.0 110.556 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.6 p-10 -98.08 26.6 5.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.644 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -90.98 26.31 2.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.843 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.417 ' OH ' HD11 ' A' ' 38' ' ' LEU . 48.7 p90 -123.91 21.09 9.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.714 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -65.45 159.25 45.26 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -63.91 -28.03 69.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.845 0.355 . . . . 0.0 110.575 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 34.9 ptt-85 -62.39 -14.2 37.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.124 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -82.7 -30.76 28.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.733 0.302 . . . . 0.0 110.698 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.456 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -58.89 -43.77 91.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.914 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.7 p -75.05 -29.74 22.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.772 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -61.63 -49.59 75.95 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.805 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.1 p -71.45 -37.68 65.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.677 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.456 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -48.83 -51.43 29.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.975 179.968 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 40.3 mmtm -65.98 -38.21 87.97 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.594 -0.443 . . . . 0.0 110.484 -179.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -67.94 -22.62 65.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.841 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -107.33 82.31 1.2 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.724 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -65.48 -6.81 14.38 Favored 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.354 2.036 . . . . 0.0 112.579 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.0 tt -57.48 -42.41 82.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.796 0.332 . . . . 0.0 110.2 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 34.8 p-10 -74.22 -15.26 61.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.836 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -74.7 -29.56 61.24 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.746 0.308 . . . . 0.0 110.615 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.3 mt . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.274 -179.995 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.921 0.391 . . . . 0.0 110.605 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 16.9 p30 -108.05 -28.84 9.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.912 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.513 HG23 ' H ' ' A' ' 18' ' ' CYS . 1.8 t -48.94 145.25 4.04 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.87 0.366 . . . . 0.0 110.669 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.73 -23.69 67.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.512 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 96.8 m -70.34 -43.88 69.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.796 0.332 . . . . 0.0 110.827 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.513 ' H ' HG23 ' A' ' 15' ' ' THR . 22.2 t -62.45 -44.35 96.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.458 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.13 -37.77 88.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.707 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.441 ' HA ' HD21 ' A' ' 23' ' ' LEU . 97.7 m -47.98 -43.45 29.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.199 -179.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -72.14 -26.63 62.18 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.825 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -73.52 -49.61 25.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.763 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.441 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.6 pp -73.05 -33.05 65.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.596 -179.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.26 -46.39 86.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.808 0.337 . . . . 0.0 110.368 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -60.7 -41.57 95.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.568 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -63.15 -38.65 92.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.736 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.54 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -54.65 -62.03 1.92 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.001 0.429 . . . . 0.0 110.048 -179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.54 ' N ' HD13 ' A' ' 27' ' ' LEU . 27.8 m -63.62 -18.75 22.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.177 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -86.41 -19.46 29.64 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.024 -179.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.4 t -85.7 19.07 2.58 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.344 -179.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.1 t -61.95 -38.24 87.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.173 0.511 . . . . 0.0 110.523 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 7.7 p-10 -72.9 -51.87 16.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.454 -0.793 . . . . 0.0 111.171 -179.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -61.14 -44.3 97.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.993 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -46.07 -57.13 4.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.67 -179.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -64.37 -36.34 93.07 Favored Glycine 0 CA--C 1.526 0.732 0 C-N-CA 120.866 -0.683 . . . . 0.0 111.528 -179.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.89 -40.83 96.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.636 0.255 . . . . 0.0 110.874 -179.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.0 mt -74.17 -42.74 51.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.769 0.319 . . . . 0.0 110.71 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 65.4 tp -59.46 -50.42 74.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.143 0.497 . . . . 0.0 110.056 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.3 m -50.15 -26.9 5.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.786 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.9 m -92.16 29.49 1.63 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.732 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.2 t -59.25 -18.78 40.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.939 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 45.5 p-10 -82.11 8.89 9.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.308 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -89.02 18.42 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-O 120.717 0.294 . . . . 0.0 110.823 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 124.83 -20.45 6.79 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 111.139 -0.784 . . . . 0.0 111.139 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 70.0 p -98.48 34.12 2.09 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.81 0.338 . . . . 0.0 110.57 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -82.84 10.18 8.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.311 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.5 m -92.9 28.48 2.07 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.82 0.343 . . . . 0.0 110.516 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 12.2 p90 -101.87 19.87 17.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.904 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.92 126.61 22.39 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -71.06 -25.79 62.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.783 0.325 . . . . 0.0 110.615 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.3 ptt-85 -68.08 -19.31 64.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.001 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.91 -30.83 62.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.742 0.305 . . . . 0.0 110.691 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.464 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -59.34 -40.45 86.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.072 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -71.9 -29.84 34.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.904 -179.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -61.13 -51.3 69.69 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.701 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.428 HG13 ' N ' ' A' ' 57' ' ' LEU . 9.1 p -70.53 -41.81 78.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.495 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.464 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -50.11 -50.73 47.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.895 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm -69.3 -28.1 65.97 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.463 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -61.03 -25.82 67.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.591 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -119.04 75.78 14.53 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.531 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -66.37 -7.36 17.37 Favored 'Trans proline' 0 C--N 1.308 -1.588 0 C-N-CA 122.554 2.17 . . . . 0.0 112.494 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.3 tt -66.76 -36.94 83.62 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.271 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -84.73 -24.51 28.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.557 179.611 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 94.2 t80 -84.82 -24.9 28.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.691 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 64.4 mt . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.365 179.983 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 52.9 m . . . . . 0 N--CA 1.47 0.568 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -103.6 30.44 5.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.659 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.8 t -148.84 147.85 29.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.686 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.61 -20.62 34.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.124 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 97.7 m -59.4 -40.08 85.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.772 0.32 . . . . 0.0 110.704 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 54.0 t -59.22 -44.3 92.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.662 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.36 -41.94 97.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.614 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 98.7 m -59.95 -45.85 91.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.745 -179.259 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -78.85 -29.83 44.84 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.779 -178.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.12 -22.65 33.31 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.185 -179.633 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 52.3 tp -83.6 -41.89 17.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.799 0.333 . . . . 0.0 110.54 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.45 -43.64 93.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.867 -179.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -63.06 -39.21 94.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.812 0.339 . . . . 0.0 111.0 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -66.03 -39.55 90.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.138 -179.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.504 ' C ' HD13 ' A' ' 27' ' ' LEU . 2.5 tm? -65.78 -52.16 53.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.772 -179.267 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.6 m -59.24 -21.74 20.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.186 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -96.01 -25.9 15.75 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.871 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.7 t -100.86 19.22 17.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.135 -179.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 41.7 t -53.21 -51.33 62.47 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.922 0.391 . . . . 0.0 110.114 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -47.93 -53.37 16.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.557 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -60.5 -40.76 92.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.661 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -55.88 -39.52 71.67 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.395 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -60.95 -40.9 99.06 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.52 -1.032 . . . . 0.0 110.52 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.78 -43.89 85.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.746 0.308 . . . . 0.0 110.746 -179.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.8 mt -67.98 -43.98 85.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.731 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.404 ' O ' HG22 ' A' ' 41' ' ' THR . 60.7 tp -58.73 -48.65 80.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.893 0.377 . . . . 0.0 110.425 -179.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 68.8 m -49.02 -32.12 8.79 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.747 -179.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.5 m -94.97 35.85 1.24 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.838 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.404 HG22 ' O ' ' A' ' 38' ' ' LEU . 13.8 t -91.67 33.19 1.03 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.734 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.8 p-10 -86.87 14.62 6.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.06 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.1 p -64.76 -22.72 31.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.755 0.312 . . . . 0.0 110.766 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 148.53 -17.82 1.29 Allowed Glycine 0 CA--C 1.528 0.855 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 84.9 p -92.45 26.89 2.44 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.739 0.304 . . . . 0.0 110.542 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -92.3 25.81 2.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.598 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.12 28.41 1.89 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.689 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -117.34 23.93 11.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.695 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -55.43 145.7 31.09 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.009 -0.837 . . . . 0.0 111.009 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.2 mtmm -62.78 -37.88 88.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.77 0.319 . . . . 0.0 110.717 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.3 ptt-85 -62.88 -17.34 61.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.112 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -74.03 -28.79 61.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.804 0.335 . . . . 0.0 110.705 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.467 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -58.71 -41.45 86.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.931 -179.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -73.04 -30.93 33.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.814 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -63.39 -50.75 68.65 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.643 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.412 HG13 ' N ' ' A' ' 57' ' ' LEU . 9.9 p -68.94 -39.19 79.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.601 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.467 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -53.26 -51.34 62.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.068 179.958 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -69.61 -35.47 75.3 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.532 -179.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.8 tmt_? -61.78 -28.92 69.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.658 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -113.4 75.16 2.29 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.75 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -68.35 -5.96 16.32 Favored 'Trans proline' 0 C--N 1.307 -1.63 0 C-N-CA 122.703 2.269 . . . . 0.0 112.548 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.7 tt -62.36 -41.09 98.33 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.896 0.379 . . . . 0.0 110.267 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -63.8 -32.87 74.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.253 179.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -74.9 -38.47 61.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.689 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.7 mt . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.436 -179.928 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.1 m . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.703 0.287 . . . . 0.0 110.665 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -99.23 -44.13 6.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.638 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.9 t -47.15 153.17 0.48 Allowed 'General case' 0 C--O 1.231 0.113 0 CA-C-O 120.892 0.377 . . . . 0.0 110.991 -179.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.95 -15.15 62.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.468 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 98.3 m -68.29 -44.48 75.4 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.832 0.349 . . . . 0.0 110.687 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 10.2 t -63.38 -43.09 98.58 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.348 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.07 -36.31 82.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.85 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.431 ' HA ' HD21 ' A' ' 23' ' ' LEU . 64.5 m -49.12 -43.87 41.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.208 -179.448 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -73.47 -26.53 60.95 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.786 -0.366 . . . . 0.0 111.139 -179.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -75.83 -39.82 55.99 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.91 -0.316 . . . . 0.0 111.017 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.431 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.4 pp -84.01 -30.45 26.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.6 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.69 -47.67 84.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.475 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.3 m-20 -64.21 -40.39 95.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.725 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -64.34 -36.84 85.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.724 -179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.528 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -53.29 -61.82 2.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.182 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.528 ' N ' HD13 ' A' ' 27' ' ' LEU . 27.1 m -64.42 -19.81 25.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.339 -179.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -95.39 -0.3 52.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.655 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.9 t -118.2 16.22 14.04 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.137 -0.225 . . . . 0.0 110.872 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.9 t -64.51 -44.55 90.56 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.223 0.535 . . . . 0.0 110.41 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -58.66 -59.63 5.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.893 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -60.51 -42.19 95.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.987 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -50.16 -43.93 52.43 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.939 -0.304 . . . . 0.0 110.932 -179.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -60.81 -37.82 94.27 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.21 -42.14 90.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.587 -0.307 . . . . 0.0 110.514 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.6 mt -69.09 -42.1 81.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.499 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 63.1 tp -58.89 -52.23 66.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.092 0.472 . . . . 0.0 109.922 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.3 t -51.67 -26.2 8.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.546 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.2 m -91.98 28.6 1.8 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.643 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.424 HG23 ' O ' ' A' ' 41' ' ' THR . 9.7 t -85.94 46.98 1.38 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.809 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 -90.66 21.43 4.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.833 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 p -90.16 20.5 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.718 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 85.14 20.99 56.4 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 61.3 p -119.64 29.41 7.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.773 0.321 . . . . 0.0 110.547 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -96.08 26.89 3.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.556 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.8 m -91.98 28.45 1.84 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.678 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.411 ' HE2' HG21 ' A' ' 41' ' ' THR . 41.2 p90 -113.98 22.64 13.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.708 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -64.6 160.44 40.8 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.049 -0.82 . . . . 0.0 111.049 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm -63.16 -31.43 72.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.822 0.344 . . . . 0.0 110.691 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.1 ptt-85 -57.96 -16.48 12.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.024 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -79.85 -26.62 40.32 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.688 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.467 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -59.73 -51.74 68.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.902 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 4.8 p -66.09 -30.29 49.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.563 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -64.67 -47.67 77.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.664 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.95 -29.56 15.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.994 -179.682 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.467 HD13 ' O ' ' A' ' 53' ' ' ALA . 1.5 mp -59.67 -44.25 93.66 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.876 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -66.79 -38.86 87.36 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.273 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -63.78 -25.21 68.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.345 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -108.67 80.48 1.23 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.368 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -65.08 -7.11 14.42 Favored 'Trans proline' 0 N--CA 1.494 1.556 0 C-N-CA 122.457 2.105 . . . . 0.0 112.771 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.0 tt -58.37 -41.04 83.88 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.377 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 -71.34 -13.9 62.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.917 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -74.53 -34.4 63.0 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.884 0.373 . . . . 0.0 110.404 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.1 mt . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.382 179.971 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 49.0 m . . . . . 0 N--CA 1.469 0.499 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 23.2 p30 -103.51 30.47 4.97 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.49 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 10.6 t -146.03 149.64 34.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.684 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.91 -22.09 65.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.211 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 97.4 m -60.29 -39.2 86.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.927 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 50.4 t -58.94 -48.28 82.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.764 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.63 -43.65 98.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.726 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.3 m -48.58 -42.86 35.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.305 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -82.95 -26.35 31.46 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -179.232 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.48 -27.79 61.58 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.616 -0.434 . . . . 0.0 111.55 -179.046 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.4 pp -84.51 -29.24 26.14 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.701 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.1 -50.27 74.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.67 -179.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -63.59 -42.52 98.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.919 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -62.13 -39.15 91.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.946 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.517 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.9 tm? -66.56 -61.53 1.93 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.546 -179.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.517 ' N ' HD13 ' A' ' 27' ' ' LEU . 24.3 m -55.46 -20.97 8.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.294 -179.596 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -97.13 -21.85 17.09 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.225 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.2 t -97.19 19.1 13.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.28 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 41.5 t -55.42 -53.05 61.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.035 0.445 . . . . 0.0 109.848 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -48.01 -51.23 24.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.44 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -61.3 -40.13 93.01 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.841 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -53.47 -39.05 64.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.777 0.322 . . . . 0.0 110.637 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.98 -43.87 96.78 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 110.569 -1.012 . . . . 0.0 110.569 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.34 -43.14 92.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.711 0.291 . . . . 0.0 110.818 -179.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.5 mt -66.56 -47.59 83.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.879 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.404 ' O ' HG22 ' A' ' 41' ' ' THR . 63.3 tp -58.97 -45.64 90.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.897 0.379 . . . . 0.0 110.51 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 71.1 m -49.52 -29.77 7.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.729 -179.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 68.5 m -94.06 34.13 1.28 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.739 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.404 HG22 ' O ' ' A' ' 38' ' ' LEU . 14.5 t -92.6 31.18 1.39 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.617 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 43.3 p-10 -94.06 23.49 4.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.741 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 p -89.34 19.71 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.806 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 112.05 -18.61 23.69 Favored Glycine 0 CA--C 1.527 0.792 0 N-CA-C 111.192 -0.763 . . . . 0.0 111.192 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 87.3 p -92.06 24.9 3.06 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.809 0.337 . . . . 0.0 110.63 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 50.3 p-10 -96.58 26.89 4.14 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.652 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.4 m -87.94 19.51 3.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.068 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 12.9 p90 -116.71 22.44 12.69 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.799 0.333 . . . . 0.0 110.55 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -58.79 153.93 28.54 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -61.79 -36.23 80.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.792 0.329 . . . . 0.0 110.692 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.2 ptt-85 -59.91 -15.56 22.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.98 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -80.25 -35.0 36.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.756 0.312 . . . . 0.0 110.547 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.414 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -58.99 -44.64 91.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.762 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 14.5 p -71.84 -32.16 43.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.638 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -62.09 -50.7 70.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.678 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 11.2 p -72.03 -32.77 45.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.928 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.414 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -53.77 -45.61 70.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.92 179.945 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -67.91 -40.46 83.4 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.39 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -63.55 -24.42 67.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.623 179.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -108.0 79.5 0.91 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.432 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -64.6 -7.67 15.19 Favored 'Trans proline' 0 N--CA 1.494 1.528 0 C-N-CA 122.361 2.041 . . . . 0.0 112.584 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.5 tt -63.81 -42.52 97.67 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.159 179.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -82.53 -5.18 58.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.957 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -74.5 -35.12 63.21 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-O 120.823 0.344 . . . . 0.0 110.489 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.3 mt . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.292 179.957 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.774 0.321 . . . . 0.0 110.685 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 12.8 p30 -125.66 -40.41 2.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.892 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.2 t -53.52 152.1 5.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.929 0.395 . . . . 0.0 110.878 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.62 -19.72 64.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.356 -179.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 92.3 m -65.03 -37.16 86.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.82 0.343 . . . . 0.0 110.706 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.0 t -59.41 -45.56 91.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.655 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.78 -39.18 90.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.725 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.446 ' HA ' HD21 ' A' ' 23' ' ' LEU . 59.4 m -47.32 -43.58 22.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.385 -179.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -77.14 -26.91 53.65 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.804 -0.358 . . . . 0.0 111.043 -179.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.7 tpp85 -69.26 -50.11 50.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.761 0.315 . . . . 0.0 110.53 -179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.446 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.5 pp -70.59 -31.72 68.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.65 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.81 -48.81 77.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.533 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -66.88 -40.13 87.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.868 0.366 . . . . 0.0 110.535 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -62.37 -27.77 69.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.908 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.516 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.8 tm? -64.46 -61.89 1.94 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.872 0.368 . . . . 0.0 110.254 -179.749 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.516 ' N ' HD13 ' A' ' 27' ' ' LEU . 19.7 m -70.67 -18.51 21.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.367 -179.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -82.18 -38.02 25.25 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.843 0.354 . . . . 0.0 110.889 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.88 19.13 18.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.203 -179.536 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.7 t -55.78 -49.35 73.39 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.129 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -50.58 -54.4 22.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.132 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -56.56 -45.83 81.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.629 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -53.55 -53.34 53.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.746 0.308 . . . . 0.0 111.124 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -67.38 -33.87 83.36 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.204 -0.758 . . . . 0.0 111.204 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.29 -42.88 99.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.735 0.302 . . . . 0.0 110.793 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.4 mt -66.09 -44.49 91.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.951 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.3 tp -65.27 -42.49 93.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.95 0.405 . . . . 0.0 110.12 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.8 m -58.89 -36.88 75.38 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.577 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 67.9 m -91.64 35.76 0.95 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.667 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.413 HG21 ' CZ ' ' A' ' 48' ' ' TYR . 9.1 t -56.62 -17.73 9.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.038 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.1 p-10 -79.32 5.01 13.53 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.359 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.6 p -88.58 16.53 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.01 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 148.14 -27.69 1.4 Allowed Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 5.9 p -99.22 34.08 2.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.849 0.357 . . . . 0.0 110.44 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.8 p-10 -63.88 -10.72 22.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.383 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -90.7 28.05 1.62 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.782 0.325 . . . . 0.0 110.818 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.413 ' CZ ' HG21 ' A' ' 41' ' ' THR . 13.8 p90 -90.01 20.01 4.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.846 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -48.04 102.6 0.05 OUTLIER Glycine 0 CA--C 1.525 0.662 0 N-CA-C 111.141 -0.783 . . . . 0.0 111.141 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.9 mtmm -79.4 -20.12 48.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.718 0.294 . . . . 0.0 110.83 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.4 ptt-85 -58.73 -15.82 13.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.139 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -74.93 -24.97 58.58 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.765 0.317 . . . . 0.0 110.749 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.459 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -58.02 -44.47 87.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.073 -179.574 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 1.6 p -77.31 -30.38 17.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.728 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -65.26 -46.34 80.92 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.791 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.407 HG13 ' N ' ' A' ' 57' ' ' LEU . 13.6 p -71.67 -38.51 66.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 120.85 -0.34 . . . . 0.0 110.577 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.459 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -49.56 -54.71 16.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.791 -179.982 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -64.3 -31.69 73.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.698 -179.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -62.71 -37.51 86.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.659 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -115.65 76.61 5.73 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.618 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -67.4 -13.03 37.92 Favored 'Trans proline' 0 C--N 1.308 -1.581 0 C-N-CA 122.7 2.267 . . . . 0.0 112.48 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 25.5 tp -58.81 -42.69 89.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.774 0.321 . . . . 0.0 110.402 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -50.7 -35.66 32.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.495 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 91.3 t80 -75.51 -47.91 24.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.69 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.7 mt . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.373 -179.975 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.847 0.356 . . . . 0.0 110.59 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -108.52 -37.78 5.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.603 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.451 HG23 ' H ' ' A' ' 18' ' ' CYS . 14.8 t -49.88 150.96 1.99 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.342 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.14 -15.68 63.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.708 -179.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 95.5 m -69.34 -40.41 77.58 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.984 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.451 ' H ' HG23 ' A' ' 15' ' ' THR . 15.5 t -64.49 -49.25 72.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.831 -179.533 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.56 -40.76 96.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.916 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.424 ' HA ' HD23 ' A' ' 23' ' ' LEU . 9.1 m -48.91 -34.46 12.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.228 -179.396 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -80.44 -26.26 38.48 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.571 -179.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.8 -25.65 60.22 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.544 -0.462 . . . . 0.0 111.288 -179.196 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' A' ' 20' ' ' THR . 1.5 pp -84.36 -26.38 28.46 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.567 179.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.39 -51.37 69.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.827 0.346 . . . . 0.0 110.486 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -64.29 -40.3 95.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.667 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -63.92 -36.71 84.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.646 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.555 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -56.1 -62.46 1.69 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.149 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.555 ' N ' HD13 ' A' ' 27' ' ' LEU . 25.7 m -66.45 -19.21 25.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.311 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -84.98 -13.18 51.45 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.322 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.8 t -85.72 19.03 2.6 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 121.098 -0.241 . . . . 0.0 111.248 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.6 t -60.59 -37.37 81.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.961 0.41 . . . . 0.0 110.774 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.3 p-10 -81.79 -50.16 9.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.237 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.439 ' O ' HD12 ' A' ' 37' ' ' ILE . 28.0 m120 -59.04 -44.24 91.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.109 -179.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -45.25 -56.31 4.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.484 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.27 -31.4 80.6 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 111.007 -0.837 . . . . 0.0 111.007 -179.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.27 -42.72 96.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.665 0.269 . . . . 0.0 110.674 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.439 HD12 ' O ' ' A' ' 33' ' ' ASN . 1.6 mp -70.2 -44.07 78.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.69 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.425 HD11 ' OH ' ' A' ' 48' ' ' TYR . 62.9 tp -60.81 -50.55 73.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.277 0.561 . . . . 0.0 109.833 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 71.2 m -48.9 -29.21 4.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.638 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.411 ' O ' HG12 ' A' ' 43' ' ' VAL . 56.3 m -90.97 36.0 0.91 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.75 -179.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.8 t -56.27 -21.69 25.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.901 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.0 p-10 -83.2 9.83 9.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.313 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.411 HG12 ' O ' ' A' ' 40' ' ' SER . 6.6 p -84.93 -21.57 7.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.761 0.315 . . . . 0.0 110.677 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 129.4 22.69 1.18 Allowed Glycine 0 CA--C 1.528 0.85 0 N-CA-C 111.079 -0.809 . . . . 0.0 111.079 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 84.5 p -124.59 33.91 5.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.844 0.354 . . . . 0.0 110.417 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 48.9 p30 -92.13 26.84 2.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.759 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.7 m -91.3 27.61 1.88 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.836 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.425 ' OH ' HD11 ' A' ' 38' ' ' LEU . 35.5 p90 -126.07 25.65 6.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.629 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.1 123.92 12.21 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -65.92 -36.73 84.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.775 0.321 . . . . 0.0 110.701 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 7.1 ptp180 -63.1 -19.2 64.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.034 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -74.29 -29.79 61.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.802 0.334 . . . . 0.0 110.653 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.468 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -58.72 -41.48 86.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.032 -179.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -71.91 -29.84 34.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.856 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -60.77 -52.2 66.09 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.606 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.408 HG13 ' N ' ' A' ' 57' ' ' LEU . 10.3 p -70.17 -39.72 77.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.56 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.468 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -53.53 -46.3 70.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.91 179.876 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -66.82 -39.48 87.71 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.374 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -66.04 -24.79 66.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.505 179.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -105.83 85.48 1.55 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.509 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -63.68 -8.19 14.76 Favored 'Trans proline' 0 N--CA 1.495 1.573 0 C-N-CA 122.25 1.967 . . . . 0.0 112.67 -179.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.4 tt -59.28 -42.38 91.11 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.24 179.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -78.63 -10.43 59.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.008 179.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -74.43 -39.13 62.79 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.797 0.332 . . . . 0.0 110.543 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.3 mt . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.297 179.966 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.891 0.376 . . . . 0.0 110.739 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 48.2 p30 -113.01 23.89 12.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.837 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.6 t -130.7 154.11 48.27 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.458 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.04 -19.89 55.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.259 -179.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 98.1 m -63.21 -41.68 99.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.754 0.311 . . . . 0.0 110.896 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 44.1 t -60.35 -45.45 93.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.609 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.4 -40.62 97.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.729 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.458 ' HA ' HD21 ' A' ' 23' ' ' LEU . 84.8 m -45.79 -42.76 12.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.454 -179.36 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -82.1 -26.63 33.42 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.953 -179.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.5 tpp85 -66.97 -49.65 64.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.749 0.309 . . . . 0.0 110.708 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.458 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.6 pp -64.56 -32.64 74.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.499 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.66 -44.36 90.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.492 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -64.39 -40.79 96.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.937 0.399 . . . . 0.0 110.529 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -62.04 -33.68 74.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.903 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.533 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -58.88 -62.09 2.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.118 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.533 ' N ' HD13 ' A' ' 27' ' ' LEU . 29.2 m -64.48 -18.42 23.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.357 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -86.44 -28.32 23.58 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.023 -179.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.2 t -96.49 19.21 12.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.244 -179.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 40.4 t -55.53 -56.72 17.03 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.283 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -49.15 -50.18 38.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.408 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 28.3 m120 -58.24 -43.6 87.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.738 179.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -53.79 -50.07 66.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.724 0.297 . . . . 0.0 110.94 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -64.79 -39.44 96.61 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.88 -43.17 98.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.743 0.306 . . . . 0.0 110.802 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 80.1 mt -69.34 -44.54 80.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.883 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 62.1 tp -61.0 -44.17 97.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.985 0.421 . . . . 0.0 110.181 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.5 m -53.48 -34.78 59.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.607 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.1 m -91.08 35.71 0.91 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.675 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.8 t -57.3 -17.49 12.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.006 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 33.4 p-10 -53.86 -22.15 9.19 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.697 0.284 . . . . 0.0 110.784 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 9.8 p -52.55 -24.1 5.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.68 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 130.58 26.89 0.77 Allowed Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 78.9 p -122.77 28.65 7.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.743 0.306 . . . . 0.0 110.499 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 -93.15 21.63 5.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.807 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.0 m -92.98 28.55 2.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.818 0.342 . . . . 0.0 110.566 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 19.7 p90 -122.33 24.61 9.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.623 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.1 119.2 5.85 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -70.72 -25.46 62.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.765 0.317 . . . . 0.0 110.666 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -67.11 -18.67 65.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.015 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.25 -25.48 55.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.811 0.339 . . . . 0.0 110.702 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.37 -39.89 88.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.969 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -78.18 -30.14 15.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.639 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -62.77 -49.91 73.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.712 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.426 HG13 ' N ' ' A' ' 57' ' ' LEU . 8.8 p -66.82 -40.92 86.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.592 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.426 ' N ' HG13 ' A' ' 56' ' ' VAL . 0.4 OUTLIER -52.91 -51.89 59.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.96 -179.943 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -63.57 -22.21 66.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.831 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -67.28 -34.79 78.16 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.78 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -123.98 75.05 57.92 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.67 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -68.49 -19.92 42.23 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 122.737 2.292 . . . . 0.0 112.3 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.4 tt -60.89 -42.83 98.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.596 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.15 -32.81 74.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.747 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -74.73 -41.46 60.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.788 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.9 mt . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.426 -179.771 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 11.9 m . . . . . 0 N--CA 1.47 0.532 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.2 p30 -105.7 30.63 5.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.598 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.5 t -143.09 147.79 35.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.751 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.6 -26.61 65.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.161 -179.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 95.1 m -58.01 -38.68 76.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.98 -179.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 48.3 t -59.82 -45.04 93.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.862 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.68 -44.4 93.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.651 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 96.9 m -56.06 -43.99 78.47 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.19 -179.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -73.94 -56.14 5.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.722 -179.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.43 -27.58 64.45 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.348 -179.225 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.3 tp -71.52 -47.94 52.05 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.814 -0.355 . . . . 0.0 110.462 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.88 -42.27 93.37 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.95 -179.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -63.91 -39.36 93.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.838 0.351 . . . . 0.0 110.949 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -71.88 -36.44 70.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.959 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.485 ' C ' HD13 ' A' ' 27' ' ' LEU . 2.0 tm? -63.98 -59.44 4.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.55 -179.422 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.454 ' N ' HD13 ' A' ' 27' ' ' LEU . 35.8 m -51.08 -22.99 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.396 -179.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -94.75 -30.6 14.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.819 0.342 . . . . 0.0 110.896 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.4 t -99.31 19.51 15.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.192 -179.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.7 t -49.48 -50.38 41.59 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.778 0.323 . . . . 0.0 110.316 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 -46.93 -52.08 15.39 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.462 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.8 m-20 -56.98 -44.92 83.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.386 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -57.01 -45.69 82.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.823 0.344 . . . . 0.0 110.431 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -62.04 -49.69 72.82 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.41 -42.07 81.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.719 0.295 . . . . 0.0 110.908 -179.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 77.3 mt -63.87 -48.57 85.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.952 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.1 tp -62.97 -39.07 93.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.785 0.326 . . . . 0.0 110.555 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.2 t -49.58 -31.04 9.72 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.63 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 70.9 m -90.52 36.03 0.89 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.824 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.8 t -85.61 15.86 4.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.226 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -92.75 15.57 14.28 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.978 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.3 p -90.63 19.92 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 CA-C-O 120.785 0.326 . . . . 0.0 110.749 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 108.78 20.52 8.01 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 111.176 -0.769 . . . . 0.0 111.176 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 77.2 p -125.36 28.43 6.31 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.798 0.332 . . . . 0.0 110.479 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -94.37 22.07 6.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.855 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.4 m -93.65 26.26 3.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.627 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 20.1 p90 -118.8 22.43 11.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.803 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -48.94 108.0 0.36 Allowed Glycine 0 CA--C 1.525 0.66 0 N-CA-C 111.022 -0.831 . . . . 0.0 111.022 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -70.18 -27.25 64.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.79 0.329 . . . . 0.0 110.518 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -59.76 -18.69 45.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.933 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.98 -25.8 31.93 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.82 0.343 . . . . 0.0 110.583 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.457 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -61.41 -45.11 95.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.891 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 8.1 p -73.56 -30.61 30.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.6 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -64.26 -45.52 87.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.688 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 14.4 p -75.79 -31.73 23.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.722 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.457 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -61.58 -39.71 92.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.795 0.331 . . . . 0.0 110.626 179.768 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -62.2 -44.67 96.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.717 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -69.48 -38.47 77.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.648 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -76.1 157.31 83.41 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.449 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.46 -4.97 16.25 Favored 'Trans proline' 0 N--CA 1.493 1.492 0 C-N-CA 122.529 2.152 . . . . 0.0 112.692 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.5 tt -55.62 -42.43 74.9 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.862 0.363 . . . . 0.0 110.324 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 11.4 p-10 -77.75 -23.74 49.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.571 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -74.57 -35.4 63.03 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.689 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.2 mt . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.357 -179.951 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.796 0.331 . . . . 0.0 111.056 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -112.83 -36.12 5.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.017 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.471 HG23 ' H ' ' A' ' 18' ' ' CYS . 2.4 t -45.92 145.28 1.53 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.965 0.412 . . . . 0.0 111.096 -179.514 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.94 -21.25 66.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.169 -179.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 95.9 m -69.5 -40.86 76.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.815 0.34 . . . . 0.0 110.742 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.471 ' H ' HG23 ' A' ' 15' ' ' THR . 20.4 t -61.57 -46.7 88.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.647 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.31 -36.55 84.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.818 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.5 m -47.77 -41.88 24.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.09 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -76.22 -26.57 56.2 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.765 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -71.61 -44.08 65.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.853 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.6 pp -78.61 -30.42 46.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.803 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.48 -49.98 75.39 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.264 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -63.9 -38.6 91.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.417 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -62.79 -34.72 77.86 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.822 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.533 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -57.84 -61.98 2.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.974 0.416 . . . . 0.0 110.107 -179.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.533 ' N ' HD13 ' A' ' 27' ' ' LEU . 34.2 m -67.6 -18.61 24.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.544 -179.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -87.61 -21.89 25.07 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.293 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.0 t -100.81 19.04 17.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.266 -179.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.2 t -62.36 -52.8 62.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.979 0.419 . . . . 0.0 110.618 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -54.41 -51.95 63.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.836 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -61.06 -42.88 99.31 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.767 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -48.9 -48.96 42.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.073 -179.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.4 -39.52 97.84 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 -179.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.36 -43.6 96.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.657 0.265 . . . . 0.0 111.1 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.3 mt -74.59 -43.72 47.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.031 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 65.7 tp -58.93 -48.59 80.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.934 0.397 . . . . 0.0 110.491 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.7 m -48.95 -27.32 3.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.719 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.9 m -90.76 36.12 0.9 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.695 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 6.3 t -86.37 45.64 1.26 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.732 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 48.1 p-10 -98.61 21.16 11.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.708 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -88.45 15.9 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.78 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 100.91 8.94 47.06 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 59.4 p -109.39 26.22 10.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.786 0.327 . . . . 0.0 110.514 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -92.5 24.5 3.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.652 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.46 23.48 3.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.715 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 21.6 p90 -106.9 18.78 21.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.596 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -52.16 142.4 23.22 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -61.77 -38.64 88.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.757 0.313 . . . . 0.0 110.599 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.0 ptt-85 -67.26 -16.09 64.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.057 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.93 -27.02 36.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.794 0.331 . . . . 0.0 110.617 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.3 -43.17 92.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.908 -179.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.2 p -75.48 -29.71 21.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.695 -179.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.5 tm-20 -63.58 -47.54 81.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.69 0.281 . . . . 0.0 110.842 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.6 p -72.75 -37.56 55.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.597 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.61 -51.82 65.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.92 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -69.3 -26.79 64.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.883 0.373 . . . . 0.0 110.557 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -67.66 -31.45 71.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.81 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -123.07 74.2 48.51 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.761 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -69.16 -8.23 23.02 Favored 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.821 2.347 . . . . 0.0 112.616 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.3 tt -64.73 -42.59 95.1 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.858 0.361 . . . . 0.0 110.443 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -57.74 -32.05 67.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.533 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -80.13 -43.78 21.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.788 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 32.9 mt . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.364 -179.963 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -73.62 153.21 49.01 Favored 'Trans proline' 0 N--CA 1.492 1.392 0 C-N-CA 122.319 2.013 . . . . 0.0 112.094 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.7 tp -69.04 140.05 19.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.542 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -65.07 141.92 58.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.563 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.3 p -72.26 161.41 30.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.506 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -94.94 21.97 7.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.784 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -82.44 132.49 35.21 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.593 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.4 p -134.2 142.9 39.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.544 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -141.05 70.91 1.35 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.591 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.33 165.68 0.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.601 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.14 164.61 30.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.665 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -59.23 153.05 19.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.723 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.5 m -67.71 80.44 0.19 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.823 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 25.2 p30 -111.49 -17.63 13.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.064 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 13.2 t -87.87 150.23 23.64 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.823 0.344 . . . . 0.0 110.67 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.57 -17.74 56.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.286 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 96.2 m -63.68 -39.24 93.82 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 121.007 -0.277 . . . . 0.0 110.742 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 51.3 t -58.64 -50.71 72.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.724 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.51 -39.87 92.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.646 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.427 ' HA ' HD21 ' A' ' 23' ' ' LEU . 94.9 m -46.34 -42.74 15.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.551 -179.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -82.65 -26.89 31.74 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.13 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.5 tpp85 -67.74 -44.79 76.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.716 0.293 . . . . 0.0 110.959 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.427 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.5 pp -69.8 -32.04 70.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.813 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.47 -45.32 88.87 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.933 -0.307 . . . . 0.0 110.655 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 29.5 m120 -65.95 -39.34 90.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.968 0.413 . . . . 0.0 110.542 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -63.99 -33.51 75.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.852 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.549 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -55.33 -62.19 1.83 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.905 0.383 . . . . 0.0 110.236 -179.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.549 ' N ' HD13 ' A' ' 27' ' ' LEU . 31.7 m -62.09 -18.26 19.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.378 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -86.72 -28.4 23.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.025 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.41 19.08 19.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.313 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.0 t -53.55 -51.69 62.11 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.491 -0.484 . . . . 0.0 110.187 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -49.75 -53.89 22.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.202 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -56.77 -43.08 80.47 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.84 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -58.14 -51.1 71.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.709 0.29 . . . . 0.0 111.377 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.83 -44.69 91.57 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 120.974 -0.631 . . . . 0.0 111.527 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.48 -40.98 96.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.739 0.305 . . . . 0.0 110.987 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.2 mt -70.09 -45.19 77.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.066 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.41 HD11 ' CZ ' ' A' ' 48' ' ' TYR . 53.8 tp -64.79 -38.32 90.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.871 0.367 . . . . 0.0 110.471 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.6 m -55.07 -35.15 64.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.709 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 73.3 m -89.38 20.81 3.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.045 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.0 t -55.73 -21.72 20.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.807 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 45.0 p-10 -56.66 -18.04 10.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.974 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.0 p -53.4 -22.84 6.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.678 0.275 . . . . 0.0 110.807 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 148.52 -15.09 1.24 Allowed Glycine 0 CA--C 1.528 0.851 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 80.4 p -92.56 32.53 1.21 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.783 0.325 . . . . 0.0 110.593 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.2 p-10 -94.01 23.4 4.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.824 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.69 28.51 2.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.579 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.41 ' CZ ' HD11 ' A' ' 38' ' ' LEU . 17.7 p90 -118.04 24.35 11.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.684 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -48.18 105.44 0.12 Allowed Glycine 0 CA--C 1.526 0.729 0 N-CA-C 111.061 -0.815 . . . . 0.0 111.061 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -70.58 -24.87 62.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.755 0.312 . . . . 0.0 110.724 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.4 ptt-85 -61.74 -18.4 59.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.904 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -67.54 -24.96 65.6 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.825 0.345 . . . . 0.0 110.608 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.457 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -55.18 -38.77 68.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.702 -179.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.57 -30.62 17.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.492 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -63.59 -48.76 76.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.699 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.412 HG13 ' N ' ' A' ' 57' ' ' LEU . 9.0 p -67.81 -39.82 82.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.572 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.457 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -48.2 -56.0 9.03 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.985 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -63.27 -32.15 73.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.961 0.41 . . . . 0.0 110.5 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -66.96 -29.23 69.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.625 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -122.95 74.63 48.05 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.701 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -68.0 -11.15 31.13 Favored 'Trans proline' 0 C--N 1.307 -1.632 0 C-N-CA 122.821 2.347 . . . . 0.0 112.549 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.9 tt -58.78 -42.49 89.14 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.743 0.306 . . . . 0.0 110.487 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 18.3 p-10 -52.13 -31.31 30.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.551 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 93.5 t80 -80.45 -47.84 13.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.698 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.5 mt -68.11 159.0 82.32 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.387 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -52.89 141.73 54.82 Favored 'Trans proline' 0 N--CA 1.494 1.532 0 C-N-CA 122.424 2.083 . . . . 0.0 112.07 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 87.4 mt . . . . . 0 C--O 1.221 -0.444 0 CA-C-O 118.028 -0.986 . . . . 0.0 110.536 179.934 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -69.61 154.74 67.93 Favored 'Trans proline' 0 C--N 1.309 -1.521 0 C-N-CA 122.442 2.095 . . . . 0.0 111.956 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 tp -50.16 133.16 9.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.566 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -70.36 152.45 44.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.513 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 82.6 p -70.8 168.14 17.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.588 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 33.4 p80 -90.5 22.55 3.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.825 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -66.21 141.65 57.98 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.576 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.9 p -126.75 140.2 49.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.568 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -143.59 67.76 1.29 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.551 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -58.11 153.87 13.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.57 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.28 173.71 11.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.665 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -71.44 142.89 50.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.515 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -53.39 95.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.055 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -114.34 -40.36 3.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.904 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.463 HG23 ' H ' ' A' ' 18' ' ' CYS . 15.3 t -51.34 145.71 7.95 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.941 0.4 . . . . 0.0 110.552 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.93 -16.79 63.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.44 -179.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 93.4 m -68.18 -36.65 79.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.797 0.332 . . . . 0.0 110.663 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.463 ' H ' HG23 ' A' ' 15' ' ' THR . 45.5 t -59.95 -48.52 81.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.691 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.0 -33.87 74.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.609 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.8 m -62.08 -47.41 84.78 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.16 -179.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -74.3 -30.93 62.29 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.934 -0.307 . . . . 0.0 111.563 -179.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.32 -24.8 36.91 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.68 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.7 tp -75.36 -40.55 57.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.491 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.04 -50.06 74.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.802 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -63.96 -41.41 97.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.891 0.376 . . . . 0.0 110.796 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -67.61 -30.38 69.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.865 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.549 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -59.91 -62.14 2.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.927 0.394 . . . . 0.0 110.176 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.549 ' N ' HD13 ' A' ' 27' ' ' LEU . 28.2 m -65.23 -21.85 30.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.245 -179.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -84.51 -25.66 28.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.334 -179.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.8 t -100.47 18.97 17.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.257 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.3 t -60.31 -50.44 73.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.195 0.521 . . . . 0.0 110.258 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 14.5 p-10 -54.38 -48.74 71.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.437 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -62.55 -42.03 99.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.891 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -47.87 -50.07 27.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.654 0.264 . . . . 0.0 111.145 -179.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.38 -37.87 95.51 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.12 -44.05 97.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.616 0.245 . . . . 0.0 110.816 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.4 mt -71.8 -44.53 68.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.888 -0.325 . . . . 0.0 110.775 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 59.2 tp -59.37 -45.56 91.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.083 0.468 . . . . 0.0 110.024 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.6 m -51.86 -25.05 7.07 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.779 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.442 ' O ' HG12 ' A' ' 43' ' ' VAL . 69.5 m -91.14 25.35 2.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.76 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 15.3 t -56.73 -21.46 28.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.838 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -80.58 7.68 9.5 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.405 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.442 HG12 ' O ' ' A' ' 40' ' ' SER . 4.3 p -89.98 20.02 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-O 120.815 0.34 . . . . 0.0 110.76 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 115.7 -15.19 17.07 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 111.327 -0.709 . . . . 0.0 111.327 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 80.3 p -102.18 33.58 3.03 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.762 0.315 . . . . 0.0 110.616 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.3 p-10 -91.39 22.71 3.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.784 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.9 m -93.41 28.34 2.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.591 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -99.43 18.65 17.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.954 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.5 108.9 0.51 Allowed Glycine 0 CA--C 1.525 0.689 0 N-CA-C 111.029 -0.828 . . . . 0.0 111.029 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -72.6 -25.74 61.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.829 0.347 . . . . 0.0 110.705 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 34.8 ptt-85 -65.53 -15.09 62.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.11 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -82.34 -32.39 29.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.788 0.327 . . . . 0.0 110.575 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.51 -44.26 89.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.978 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.8 p -72.78 -28.57 27.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.766 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -57.52 -46.78 83.42 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.686 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -68.91 -32.53 54.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.464 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.9 mp -54.77 -54.31 43.76 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.951 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -69.48 -28.13 65.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.935 0.398 . . . . 0.0 110.623 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -65.82 -37.01 85.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.888 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -119.07 75.2 14.33 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.666 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -71.15 -7.08 20.61 Favored 'Trans proline' 0 C--N 1.305 -1.711 0 C-N-CA 122.656 2.237 . . . . 0.0 112.522 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.48 HD21 HD11 ' A' ' 67' ' ' LEU . 3.9 tt -66.8 -42.88 85.23 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.787 0.327 . . . . 0.0 110.626 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -67.02 -30.82 71.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.593 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -76.5 -44.36 35.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.58 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 90.2 mt -72.42 158.94 86.62 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.296 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -51.92 139.72 50.12 Favored 'Trans proline' 0 N--CA 1.494 1.507 0 C-N-CA 122.372 2.048 . . . . 0.0 112.125 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.48 HD11 HD21 ' A' ' 62' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.595 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.515 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -74.36 155.29 46.12 Favored 'Trans proline' 0 C--N 1.308 -1.574 0 C-N-CA 122.569 2.18 . . . . 0.0 112.175 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.4 tp -50.85 137.17 8.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.586 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 -64.01 157.31 25.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.611 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.1 p -71.04 164.6 25.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.522 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.6 p80 -89.6 20.27 4.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.841 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -62.94 135.17 57.16 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.787 0.327 . . . . 0.0 110.591 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.2 p -51.96 135.97 12.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.473 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -146.63 164.7 31.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.62 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -138.9 160.86 38.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.651 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.51 63.45 1.26 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.528 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.1 pttp -52.44 148.97 6.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.581 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.68 90.04 0.27 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.696 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -110.74 -32.38 6.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.72 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.526 HG23 ' H ' ' A' ' 18' ' ' CYS . 2.4 t -47.96 145.14 3.15 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.939 0.399 . . . . 0.0 110.811 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.25 -21.97 66.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.204 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 92.8 m -70.85 -41.6 71.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.853 0.359 . . . . 0.0 110.746 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.526 ' H ' HG23 ' A' ' 15' ' ' THR . 50.9 t -62.08 -47.65 83.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.774 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.51 -36.07 81.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.915 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.43 ' HA ' HD21 ' A' ' 23' ' ' LEU . 91.5 m -49.44 -45.62 46.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.375 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -69.38 -27.81 65.63 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.876 -0.329 . . . . 0.0 111.248 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.5 tpp85 -74.65 -52.51 11.48 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.735 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.43 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.6 pp -68.96 -33.92 74.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.649 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.04 -46.6 85.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.73 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 31.3 m-20 -64.13 -39.95 95.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.867 0.365 . . . . 0.0 110.74 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -62.44 -31.62 72.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.773 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.532 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -64.1 -61.91 1.96 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.272 -179.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.532 ' N ' HD13 ' A' ' 27' ' ' LEU . 33.4 m -63.6 -18.45 22.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.629 -179.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -92.71 -26.9 17.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.259 -179.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.3 t -104.87 19.3 20.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.168 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 44.6 t -58.14 -51.2 70.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.027 0.442 . . . . 0.0 110.486 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -52.03 -51.85 54.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.551 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -60.7 -42.03 96.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.647 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -53.06 -48.61 67.55 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.001 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.02 -38.22 96.24 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 -179.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.22 -44.14 97.75 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.685 0.279 . . . . 0.0 110.804 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.9 mt -72.23 -46.36 58.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.977 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 61.1 tp -58.25 -45.89 86.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.02 0.438 . . . . 0.0 110.261 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.8 m -49.47 -27.72 4.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.832 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 71.2 m -91.92 31.66 1.22 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.7 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.4 t -67.22 -8.92 35.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.267 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.2 p-10 -82.56 9.53 9.17 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 120.917 -0.313 . . . . 0.0 111.299 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 p -89.48 19.7 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-O 120.812 0.339 . . . . 0.0 110.776 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 115.56 -17.12 16.35 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 111.235 -0.746 . . . . 0.0 111.235 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 81.7 p -94.74 29.71 2.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.832 0.349 . . . . 0.0 110.569 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -92.81 23.6 4.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.738 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.7 m -92.82 28.5 2.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.581 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -119.24 25.12 10.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.646 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -48.58 114.09 1.84 Allowed Glycine 0 CA--C 1.526 0.73 0 N-CA-C 111.091 -0.804 . . . . 0.0 111.091 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -66.89 -33.73 76.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.775 0.322 . . . . 0.0 110.662 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.3 ptt-85 -61.31 -16.24 43.77 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.051 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -82.59 -25.34 33.32 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.824 0.345 . . . . 0.0 110.654 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.452 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -59.87 -42.51 93.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.805 -179.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.3 p -77.8 -28.85 15.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.779 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -64.51 -45.98 84.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.661 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.0 p -73.61 -36.24 46.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.672 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.452 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -48.32 -49.92 32.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.043 179.984 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 40.3 mmtm -63.28 -40.32 97.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.921 0.391 . . . . 0.0 110.488 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -69.43 -21.96 63.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.791 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -114.92 74.59 3.53 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.626 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -67.52 -6.8 17.45 Favored 'Trans proline' 0 C--N 1.307 -1.625 0 C-N-CA 122.79 2.327 . . . . 0.0 112.473 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.406 ' CD2' HD11 ' A' ' 67' ' ' LEU . 6.4 tt -61.18 -42.15 98.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.729 0.3 . . . . 0.0 110.401 179.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 34.5 p-10 -54.67 -25.25 25.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.582 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -74.79 -47.56 30.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.505 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.0 mt -70.22 158.85 86.53 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.353 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -52.55 140.31 55.14 Favored 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 122.403 2.068 . . . . 0.0 112.11 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.406 HD11 ' CD2' ' A' ' 62' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.22 -0.492 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.552 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -73.26 158.57 48.52 Favored 'Trans proline' 0 C--N 1.309 -1.551 0 C-N-CA 122.613 2.209 . . . . 0.0 112.186 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 tp -49.55 137.98 5.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.598 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -62.04 175.75 0.66 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.553 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 82.9 p -68.47 168.59 12.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.517 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.9 p80 -53.36 -25.65 16.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.586 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -65.24 133.13 50.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.531 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.1 p -134.6 141.92 41.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.601 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -148.36 158.67 44.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.528 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.9 pttm -71.82 128.4 35.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.641 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.47 63.24 1.27 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.491 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -88.34 139.98 29.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.632 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 49.1 m 31.84 81.74 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.538 0 O-C-N 124.136 0.898 . . . . 0.0 112.144 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.0 p30 -106.63 30.63 5.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.602 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.2 t -148.87 150.55 33.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.594 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.53 -21.4 64.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.068 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 98.4 m -58.96 -38.48 79.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.783 0.325 . . . . 0.0 110.675 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 47.7 t -58.51 -44.54 89.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.716 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.57 -39.65 91.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.685 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 98.8 m -59.63 -48.67 80.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.577 -179.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -75.28 -30.96 60.58 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.717 -178.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.17 -22.98 38.53 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.897 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 63.3 tp -74.41 -45.17 48.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.601 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.82 -44.53 86.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.977 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.73 -41.69 98.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.789 0.328 . . . . 0.0 110.804 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -66.98 -36.68 82.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.811 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.538 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -58.68 -62.01 2.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.331 -179.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.538 ' N ' HD13 ' A' ' 27' ' ' LEU . 34.4 m -54.53 -19.48 3.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.482 -179.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -97.19 -18.92 18.97 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.267 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.5 t -104.44 19.39 20.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.053 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 41.8 t -54.15 -51.96 62.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.865 0.364 . . . . 0.0 110.382 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 -48.9 -52.23 25.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.411 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.7 m120 -60.14 -41.83 93.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.522 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -56.92 -49.45 75.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.774 0.321 . . . . 0.0 110.715 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.36 -41.63 99.38 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.889 -0.885 . . . . 0.0 110.889 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.75 -44.18 97.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.706 0.289 . . . . 0.0 111.049 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 80.7 mt -70.82 -45.97 70.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.167 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 57.7 tp -61.48 -43.72 98.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.869 0.366 . . . . 0.0 110.556 -179.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.7 m -52.32 -24.37 7.42 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.859 -179.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 72.4 m -90.79 35.85 0.9 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.783 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.0 t -85.68 48.82 1.65 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.673 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.4 p-10 -78.49 0.8 24.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.176 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 10.0 p -65.08 -25.47 37.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 CA-C-O 120.824 0.345 . . . . 0.0 110.671 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 117.86 22.61 3.88 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 111.126 -0.79 . . . . 0.0 111.126 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 78.8 p -110.32 28.23 8.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.794 0.33 . . . . 0.0 110.563 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 48.9 p-10 -95.93 26.45 4.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.575 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.2 m -91.4 24.48 2.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.771 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 41.7 p90 -120.3 24.27 10.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.601 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -55.91 147.3 30.08 Favored Glycine 0 CA--C 1.525 0.656 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -62.81 -37.2 85.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.702 0.287 . . . . 0.0 110.591 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.1 ptt-85 -66.13 -18.26 65.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.006 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -73.66 -25.34 60.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.749 0.309 . . . . 0.0 110.579 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.453 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -57.69 -40.63 79.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.778 -179.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -75.21 -30.67 23.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.608 -179.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -61.69 -49.01 78.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.724 0.297 . . . . 0.0 110.797 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.407 HG13 ' N ' ' A' ' 57' ' ' LEU . 10.3 p -70.78 -39.99 76.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.603 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.453 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.5 OUTLIER -48.46 -56.17 8.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.064 179.987 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -65.34 -33.91 77.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.974 0.416 . . . . 0.0 110.635 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -63.49 -35.24 79.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.822 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -114.19 75.17 3.05 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.789 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -68.02 -9.49 25.87 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 C-N-CA 122.752 2.301 . . . . 0.0 112.498 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.0 tt -60.23 -42.43 95.19 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.766 0.317 . . . . 0.0 110.394 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 24.0 p-10 -50.41 -29.9 11.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.484 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -74.69 -44.62 49.23 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.618 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.5 mt -70.22 158.82 86.59 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.288 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -53.2 141.67 58.28 Favored 'Trans proline' 0 N--CA 1.494 1.516 0 C-N-CA 122.353 2.035 . . . . 0.0 112.053 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.219 -0.511 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.505 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -74.18 153.46 46.13 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.555 2.17 . . . . 0.0 112.173 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 tp -54.29 141.32 10.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.581 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 22.8 pt-20 -59.03 139.62 56.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.653 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 95.7 p -86.6 160.94 18.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.66 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.8 p80 -65.05 -23.29 67.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.709 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -60.96 137.74 58.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.5 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 8.9 p -126.5 139.79 50.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.545 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -130.05 59.03 1.64 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.463 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 26.3 pttm -101.65 175.78 5.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.467 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.61 170.46 15.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.642 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.8 pttp -67.05 145.08 55.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.563 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.2 m -57.59 94.96 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.654 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -120.09 -36.49 3.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.755 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.6 t -67.24 145.46 55.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.697 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.13 -17.58 28.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.215 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 96.0 m -63.23 -38.71 92.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.739 0.304 . . . . 0.0 110.688 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 52.4 t -59.15 -50.17 75.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.601 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.16 -39.09 89.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.664 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 97.5 m -47.94 -46.11 31.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.358 -179.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -68.72 -28.24 66.65 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.838 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.3 tpp85 -72.22 -44.28 63.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.878 0.37 . . . . 0.0 110.535 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 62.6 tp -57.93 -46.7 84.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.637 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.98 -45.84 71.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.74 -179.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -68.19 -40.55 82.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.908 0.385 . . . . 0.0 110.564 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -64.91 -27.35 68.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.926 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.516 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.8 tm? -61.34 -61.7 2.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.376 -179.592 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.516 ' N ' HD13 ' A' ' 27' ' ' LEU . 32.8 m -69.4 -18.38 22.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.478 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -80.63 -38.03 29.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.838 0.352 . . . . 0.0 110.74 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.9 t -94.67 18.82 10.88 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.237 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.7 t -58.84 -48.45 81.29 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.108 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -50.43 -56.4 11.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.074 179.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -56.74 -44.89 82.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.885 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -55.23 -54.5 42.59 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.705 0.288 . . . . 0.0 111.313 -179.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.69 -38.4 94.49 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 111.356 -0.697 . . . . 0.0 111.356 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.72 -40.7 95.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.807 0.337 . . . . 0.0 110.667 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.4 mt -68.2 -43.53 84.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.997 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 56.8 tp -65.42 -41.67 93.32 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.154 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.7 m -59.23 -35.22 73.26 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.501 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 52.5 m -91.56 35.39 0.95 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.673 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.9 t -56.72 -20.94 24.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.932 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 47.1 p-10 -56.21 -18.33 9.99 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.014 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.2 p -51.89 -25.18 5.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 120.731 0.301 . . . . 0.0 110.721 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 148.11 -14.48 1.3 Allowed Glycine 0 CA--C 1.528 0.864 0 N-CA-C 111.459 -0.656 . . . . 0.0 111.459 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 81.6 p -91.94 34.0 1.03 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.757 0.313 . . . . 0.0 110.68 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 44.7 p-10 -73.96 -0.81 17.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.375 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.5 m -92.13 28.12 1.98 Allowed 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.73 0.3 . . . . 0.0 110.606 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 13.0 p90 -98.53 19.27 14.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.924 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.59 102.64 0.06 OUTLIER Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm -80.18 -23.04 41.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.776 0.322 . . . . 0.0 110.661 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.1 ptt-85 -59.55 -19.01 45.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.946 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -62.61 -25.83 68.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.77 0.319 . . . . 0.0 110.608 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.459 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -54.73 -38.23 66.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.695 -179.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -76.83 -30.35 18.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.631 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -63.18 -51.01 68.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.665 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.407 HG13 ' N ' ' A' ' 57' ' ' LEU . 9.2 p -65.62 -39.27 84.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.502 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.459 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -47.74 -56.03 8.26 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.812 -179.843 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 40.5 mmtm -62.8 -35.34 79.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.935 0.398 . . . . 0.0 110.441 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.0 tmt_? -61.91 -37.49 84.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.601 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -110.66 76.11 1.11 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.509 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -64.57 -14.9 47.11 Favored 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.64 2.227 . . . . 0.0 112.409 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.2 tt -53.18 -41.41 65.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.425 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 30.2 p-10 -48.79 -29.97 5.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.582 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -74.72 -47.86 29.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.684 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.1 mt -60.57 158.84 28.13 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.396 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -53.01 141.68 56.18 Favored 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 122.377 2.051 . . . . 0.0 112.082 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 18.6 mt . . . . . 0 C--O 1.22 -0.483 0 CA-C-O 118.038 -0.982 . . . . 0.0 110.518 179.922 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.514 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -72.75 152.8 53.39 Favored 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.58 2.186 . . . . 0.0 112.132 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.0 tp -56.76 144.41 8.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.581 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -59.45 157.66 10.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.587 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 69.4 m -63.26 145.83 54.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.553 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -90.55 21.41 3.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.841 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -75.79 131.94 40.09 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.78 0.324 . . . . 0.0 110.524 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.6 p -52.67 139.86 9.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.532 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -145.58 168.22 21.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.657 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -138.98 155.91 47.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.552 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.24 63.34 1.28 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.096 0.474 . . . . 0.0 110.567 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -56.4 149.7 16.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.513 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -57.43 96.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.498 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -120.86 -36.52 3.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.699 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 13.3 t -61.2 145.28 51.72 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.538 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.54 -18.95 55.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.508 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 93.4 m -65.13 -39.83 93.6 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.782 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 52.3 t -63.3 -48.87 76.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.665 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.18 -39.07 91.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.609 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.465 ' HA ' HD21 ' A' ' 23' ' ' LEU . 89.9 m -48.63 -41.41 31.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.235 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -80.13 -26.4 39.45 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.123 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -70.93 -55.06 9.22 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.603 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.465 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.5 pp -61.01 -31.38 71.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.6 -179.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.28 -41.58 89.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.71 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -62.83 -39.82 95.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.859 0.362 . . . . 0.0 110.625 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -65.01 -28.36 69.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.859 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -65.81 -61.78 1.87 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.73 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.2 m -68.52 -18.53 23.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.193 -179.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -85.48 -34.18 21.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.886 0.374 . . . . 0.0 110.526 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.6 t -96.39 19.05 12.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.161 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.1 t -57.99 -45.04 87.43 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.178 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -53.31 -55.14 27.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.117 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -57.48 -46.3 83.86 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.979 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -56.29 -54.74 41.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.692 0.282 . . . . 0.0 111.395 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.23 -35.97 92.26 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 111.246 -0.741 . . . . 0.0 111.246 -179.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.29 -40.52 96.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.801 0.334 . . . . 0.0 110.628 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 76.1 mt -68.85 -43.3 82.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.128 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.413 ' O ' HG22 ' A' ' 41' ' ' THR . 65.4 tp -67.55 -42.8 82.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.972 0.415 . . . . 0.0 110.296 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.0 m -62.05 -25.47 67.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.661 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.5 m -92.04 29.91 1.52 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.821 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.413 HG22 ' O ' ' A' ' 38' ' ' LEU . 14.9 t -92.48 30.29 1.54 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.58 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 50.8 p-10 -89.93 20.98 3.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.931 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.7 p -88.7 17.8 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.818 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 144.49 -23.34 2.02 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.049 -0.82 . . . . 0.0 111.049 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 37.8 m -98.2 33.9 2.08 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.803 0.335 . . . . 0.0 110.548 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.0 p-10 -62.19 -12.9 22.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.19 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.2 m -91.43 28.49 1.68 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.75 0.309 . . . . 0.0 110.76 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.3 p90 -95.39 19.93 10.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.795 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -53.58 137.97 37.95 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -70.24 -25.07 63.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.748 0.308 . . . . 0.0 110.679 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -60.3 -20.34 58.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.906 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 35.7 t30 -64.15 -26.71 68.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.783 0.325 . . . . 0.0 110.659 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.45 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -52.84 -39.57 62.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.738 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.25 -29.72 17.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.426 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -62.06 -51.22 68.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.594 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.416 HG13 ' N ' ' A' ' 57' ' ' LEU . 8.8 p -66.84 -40.37 85.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.82 0.343 . . . . 0.0 110.584 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.45 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.5 OUTLIER -50.09 -56.06 12.4 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.838 -179.882 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm -64.0 -27.81 69.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.807 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -64.46 -38.7 91.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.776 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -114.53 75.04 3.32 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.207 0.527 . . . . 0.0 110.388 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -68.48 -17.78 43.66 Favored 'Trans proline' 0 N--CA 1.495 1.577 0 C-N-CA 122.781 2.321 . . . . 0.0 112.553 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.2 tt -54.12 -42.69 69.75 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.775 0.322 . . . . 0.0 110.592 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -55.91 -33.52 64.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.519 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -74.83 -47.81 28.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.576 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.1 mt -70.9 159.51 85.22 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.414 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -52.88 140.17 58.64 Favored 'Trans proline' 0 N--CA 1.494 1.537 0 C-N-CA 122.456 2.104 . . . . 0.0 112.076 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.22 -0.478 0 CA-C-O 117.98 -1.009 . . . . 0.0 110.574 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.97 154.65 53.08 Favored 'Trans proline' 0 C--N 1.308 -1.555 0 C-N-CA 122.605 2.203 . . . . 0.0 112.126 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.5 tp -61.66 147.21 11.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.571 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -60.25 144.51 50.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.573 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.0 p -70.71 162.51 28.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.656 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.7 p80 -63.16 -23.08 67.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.732 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -54.37 135.11 45.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.578 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.3 p -134.74 144.16 35.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.583 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -140.06 175.83 9.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.614 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.84 162.25 32.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.616 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.2 150.55 36.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.564 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.401 ' HZ3' ' HB3' ' A' ' 14' ' ' ASN . 22.8 pttp -67.71 142.86 56.17 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.879 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.63 85.28 2.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.697 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.401 ' HB3' ' HZ3' ' A' ' 12' ' ' LYS . 14.2 p30 -102.6 -33.87 9.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.665 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.484 HG23 ' H ' ' A' ' 18' ' ' CYS . 2.6 t -46.57 145.34 1.87 Allowed 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.985 -179.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.85 -21.39 66.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.314 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 97.1 m -71.01 -40.36 71.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.895 0.379 . . . . 0.0 110.901 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.484 ' H ' HG23 ' A' ' 15' ' ' THR . 36.6 t -62.51 -47.61 83.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.683 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.65 -36.91 85.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.801 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.447 ' HA ' HD21 ' A' ' 23' ' ' LEU . 99.8 m -47.84 -45.39 29.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.35 -179.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -70.19 -27.97 64.92 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.862 -0.335 . . . . 0.0 111.061 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -74.29 -56.43 4.89 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.788 -0.365 . . . . 0.0 110.713 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.447 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.5 pp -64.61 -30.65 71.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.621 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.27 -46.82 88.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.487 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -61.47 -41.2 96.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.708 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -64.52 -35.61 81.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.651 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.491 ' C ' HD13 ' A' ' 27' ' ' LEU . 2.3 tm? -59.58 -53.42 58.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.118 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 32.6 m -71.06 -18.32 20.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.465 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -95.66 -12.41 25.6 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.562 -179.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.6 t -115.5 18.84 15.76 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 121.115 -0.234 . . . . 0.0 110.816 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.3 t -63.99 -46.61 83.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.265 0.555 . . . . 0.0 110.385 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -58.98 -59.13 5.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.88 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 28.1 m120 -59.68 -43.19 94.12 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.979 -179.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -52.6 -43.16 65.17 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.906 -0.317 . . . . 0.0 110.824 -179.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -59.87 -37.22 92.23 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.645 -0.982 . . . . 0.0 110.645 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.58 -43.5 93.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.721 0.296 . . . . 0.0 110.559 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 80.1 mt -69.31 -44.76 80.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.569 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 64.4 tp -55.98 -50.91 69.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.136 0.493 . . . . 0.0 109.884 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 68.9 m -47.44 -28.75 2.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.881 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 52.2 m -91.05 35.44 0.91 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.693 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.7 t -64.59 -11.25 32.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.16 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -82.1 9.08 9.2 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 120.979 -0.288 . . . . 0.0 111.283 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -89.45 19.22 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 120.954 -0.299 . . . . 0.0 110.812 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 119.23 -17.09 10.62 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 111.261 -0.736 . . . . 0.0 111.261 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 79.8 p -98.02 32.07 2.52 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.818 0.342 . . . . 0.0 110.61 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 49.6 p30 -95.24 25.44 4.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.732 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.64 28.55 1.98 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.518 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -112.71 21.31 15.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.865 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.32 132.02 25.34 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -71.06 -28.38 64.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.728 0.299 . . . . 0.0 110.608 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.4 ptt-85 -56.67 -18.36 12.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.951 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -72.14 -34.92 68.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.76 0.314 . . . . 0.0 110.551 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.458 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -59.88 -42.24 93.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.832 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.46 -29.91 48.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.485 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -71.26 -47.39 57.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.18 -179.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -73.39 -31.32 33.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.145 -179.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.458 HD13 ' O ' ' A' ' 53' ' ' ALA . 2.7 mp -64.06 -42.64 96.94 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.923 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -67.42 -39.27 85.47 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.412 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -61.42 -25.19 67.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.533 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -107.11 80.6 0.84 Allowed Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.508 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -63.16 -9.17 16.29 Favored 'Trans proline' 0 N--CA 1.495 1.581 0 C-N-CA 122.371 2.048 . . . . 0.0 112.692 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.4 tt -58.65 -42.29 88.04 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.321 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 39.5 p-10 -75.51 -12.23 60.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.037 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -74.57 -37.11 63.05 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.857 0.36 . . . . 0.0 110.489 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.2 mt -71.3 158.97 86.94 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.31 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -52.43 139.2 56.07 Favored 'Trans proline' 0 N--CA 1.494 1.508 0 C-N-CA 122.4 2.066 . . . . 0.0 112.063 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.947 -1.025 . . . . 0.0 110.582 -179.971 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.525 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -73.74 158.2 47.16 Favored 'Trans proline' 0 C--N 1.308 -1.553 0 C-N-CA 122.55 2.167 . . . . 0.0 112.253 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 tp -49.07 116.71 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.526 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.0 pt-20 -51.93 169.17 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.573 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 68.9 m -67.84 142.93 55.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.559 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 35.2 p80 -69.14 -20.25 64.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.891 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -54.77 132.15 45.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.775 0.321 . . . . 0.0 110.485 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.0 p -130.94 141.19 46.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.639 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -132.64 69.25 1.48 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.419 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -62.58 177.26 0.54 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.625 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.82 163.61 32.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.499 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -62.91 136.89 58.09 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.886 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.513 ' SG ' HG22 ' A' ' 15' ' ' THR . 20.2 t -69.14 79.04 0.34 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.695 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 47.2 p30 -87.46 -3.35 59.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.302 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.513 HG22 ' SG ' ' A' ' 13' ' ' CYS . 8.2 t -50.81 156.83 0.89 Allowed 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.835 0.35 . . . . 0.0 110.378 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.66 -34.89 65.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.87 -178.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 98.4 m -61.26 -50.21 73.97 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.947 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.435 ' H ' HG23 ' A' ' 15' ' ' THR . 60.6 m -68.08 -38.9 82.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.793 0.33 . . . . 0.0 110.564 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.17 -38.81 92.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.664 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.6 m -53.17 -47.39 68.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.462 -179.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -78.98 -27.01 43.37 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.71 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -64.18 -51.45 63.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.546 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.3 pp -72.62 -25.65 61.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.807 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.15 -52.5 58.54 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.635 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -69.07 -36.63 77.85 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.71 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -60.59 -36.25 78.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.608 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.498 ' C ' HD13 ' A' ' 27' ' ' LEU . 2.4 tm? -60.28 -51.7 68.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.021 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 27.7 m -76.04 -18.54 15.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.291 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -78.22 -41.64 33.76 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.756 0.313 . . . . 0.0 111.162 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.9 t -91.48 18.89 6.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.499 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.9 t -59.27 -50.31 74.49 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.323 -0.551 . . . . 0.0 109.964 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -48.95 -53.43 19.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.157 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -59.21 -44.73 92.26 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.606 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -51.81 -52.2 50.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.102 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -66.74 -35.63 90.02 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.347 -0.701 . . . . 0.0 111.347 -179.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.3 -41.25 98.94 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.704 0.288 . . . . 0.0 110.696 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.5 mt -72.42 -44.29 62.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.727 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.41 ' O ' HG22 ' A' ' 41' ' ' THR . 64.8 tp -60.62 -47.57 85.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.997 0.427 . . . . 0.0 110.226 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.4 t -50.04 -30.79 11.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.57 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.7 m -96.08 35.81 1.39 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.725 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.41 HG22 ' O ' ' A' ' 38' ' ' LEU . 13.4 t -91.43 34.17 0.97 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.717 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -91.75 20.79 5.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.811 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 5.4 p -101.54 4.84 10.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.785 0.326 . . . . 0.0 110.803 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 93.01 19.3 36.93 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.11 -0.796 . . . . 0.0 111.11 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 77.8 p -109.73 32.58 4.94 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.772 0.32 . . . . 0.0 110.597 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 46.2 p-10 -99.92 26.23 6.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.702 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.76 23.92 9.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.756 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 8.9 p90 -133.12 22.58 4.12 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.652 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -60.22 145.99 46.13 Favored Glycine 0 CA--C 1.524 0.603 0 N-CA-C 110.977 -0.849 . . . . 0.0 110.977 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -64.09 -36.0 82.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.778 0.323 . . . . 0.0 110.623 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.5 ptt-85 -59.75 -20.36 56.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.725 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.37 -23.63 66.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.627 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.446 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -56.51 -38.84 72.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.795 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -76.13 -32.61 23.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 120.819 -0.353 . . . . 0.0 110.444 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -64.63 -50.44 67.13 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.784 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.44 HG13 ' N ' ' A' ' 57' ' ' LEU . 7.5 p -64.09 -42.53 95.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.62 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.446 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.5 OUTLIER -47.94 -50.03 28.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.015 -179.836 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -61.28 -38.1 85.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.9 0.381 . . . . 0.0 110.522 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.8 tmt_? -65.65 -36.5 83.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.473 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -108.07 88.12 4.43 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.473 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -66.27 -5.65 13.04 Favored 'Trans proline' 0 N--CA 1.495 1.567 0 C-N-CA 122.144 1.896 . . . . 0.0 112.799 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.9 tp -60.94 -42.57 98.47 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.898 -0.321 . . . . 0.0 110.615 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -62.89 -17.34 61.53 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.937 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 55.8 t80 -74.56 -48.04 29.16 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.765 0.317 . . . . 0.0 110.321 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.1 mt -71.97 158.92 86.8 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.335 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -52.97 140.22 59.39 Favored 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 122.346 2.031 . . . . 0.0 112.052 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.539 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -73.82 165.87 31.13 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 122.514 2.143 . . . . 0.0 112.228 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.7 tp -60.08 144.58 12.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.63 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -71.23 168.84 16.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.513 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 82.7 p -67.7 162.61 23.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.585 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.5 p80 -91.15 23.15 3.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.768 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -65.92 135.82 55.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.583 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 7.0 p -137.77 146.55 27.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.516 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -143.45 162.24 36.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.603 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.5 pttt -135.24 149.95 49.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.498 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.18 178.62 7.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.641 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -80.75 148.6 30.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.51 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.57 92.79 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.697 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -114.02 -34.32 5.44 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.744 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -46.9 146.43 1.66 Allowed 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.083 -179.672 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.83 -20.96 66.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.05 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 97.8 m -69.43 -40.46 77.23 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.81 0.338 . . . . 0.0 110.733 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.6 t -60.59 -46.27 90.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.565 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.07 -29.35 69.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.803 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.5 m -61.49 -42.23 98.47 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.584 -179.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -74.52 -32.62 62.54 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.799 -178.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.84 -24.27 31.0 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.852 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 14.2 tp -77.86 -40.76 39.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.378 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.7 -45.69 91.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.795 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -63.81 -41.75 97.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.826 0.346 . . . . 0.0 110.624 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -71.2 -28.43 64.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.738 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.539 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -60.37 -62.08 2.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.08 -179.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.539 ' N ' HD13 ' A' ' 27' ' ' LEU . 21.3 m -67.8 -18.57 23.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.379 -179.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -88.58 -21.24 24.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.121 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.1 t -109.91 18.83 19.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.104 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 44.1 t -63.16 -52.46 62.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.053 0.454 . . . . 0.0 110.415 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -54.12 -57.65 10.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.837 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 29.2 m120 -58.96 -42.02 88.88 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.663 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -52.65 -41.79 64.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.18 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.8 -40.67 99.13 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.62 -42.32 87.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.724 0.297 . . . . 0.0 110.611 -179.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.4 mt -70.45 -45.73 73.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.574 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 60.7 tp -55.45 -50.92 68.58 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.944 0.402 . . . . 0.0 110.278 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.5 m -56.89 -36.0 69.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.609 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 75.1 m -90.79 35.85 0.9 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.86 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.43 HG23 ' O ' ' A' ' 41' ' ' THR . 9.6 t -85.22 47.93 1.49 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.858 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 16.4 p-10 -92.41 23.42 3.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.696 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.8 p -88.28 17.72 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.934 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.15 20.35 72.88 Favored Glycine 0 CA--C 1.53 0.974 0 N-CA-C 111.471 -0.651 . . . . 0.0 111.471 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 78.0 p -109.05 31.2 5.88 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.846 0.355 . . . . 0.0 110.359 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 19.8 p-10 -95.79 27.07 3.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.583 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.1 m -68.44 -14.09 62.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.695 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -90.32 20.72 4.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.618 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.19 144.84 7.77 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -62.37 -38.43 89.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.742 0.306 . . . . 0.0 110.509 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 34.8 ptt-85 -62.34 -14.18 36.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.142 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.44 -32.09 42.66 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.541 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.475 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -59.04 -44.6 91.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.803 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -70.2 -29.12 38.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.591 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -65.9 -46.56 77.87 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 121.007 -0.277 . . . . 0.0 110.85 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.5 p -76.62 -33.83 22.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.742 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.475 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -53.18 -50.82 63.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.889 179.935 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -68.61 -38.97 81.01 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.694 -0.403 . . . . 0.0 110.513 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.5 tmt_? -66.37 -22.24 66.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.677 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -108.26 82.59 1.61 Allowed Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.567 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -66.34 -5.96 13.84 Favored 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.375 2.05 . . . . 0.0 112.546 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 61.8 tp -62.74 -42.58 99.73 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -84.52 -8.02 59.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.986 179.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -74.85 -28.59 60.74 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-O 120.879 0.371 . . . . 0.0 110.525 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.8 mt -85.59 158.85 56.55 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.177 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -52.9 140.18 58.77 Favored 'Trans proline' 0 N--CA 1.493 1.492 0 C-N-CA 122.357 2.038 . . . . 0.0 112.066 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 117.96 -1.019 . . . . 0.0 110.562 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.46 155.81 54.9 Favored 'Trans proline' 0 N--CA 1.492 1.422 0 C-N-CA 122.32 2.014 . . . . 0.0 112.095 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.7 tp -50.46 141.07 3.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.546 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.1 pt-20 -56.02 164.8 1.12 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.587 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.2 p -69.9 161.55 29.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.652 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 33.1 p80 -64.03 -22.22 66.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.881 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -55.96 132.67 50.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.848 0.356 . . . . 0.0 110.539 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.3 p -58.2 150.92 4.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.606 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -147.62 165.57 30.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.595 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.5 pttt -138.98 147.83 42.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.602 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.42 63.51 1.27 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.592 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -60.07 147.32 39.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.636 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -73.63 86.32 1.63 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.7 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -104.43 -49.41 3.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.794 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.4 t -45.27 154.78 0.15 Allowed 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.013 0.435 . . . . 0.0 111.315 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.53 -18.27 62.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.288 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 99.1 m -63.39 -42.12 98.8 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.762 0.315 . . . . 0.0 110.775 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.6 t -61.85 -44.98 95.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.598 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.51 -34.18 72.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.89 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 78.7 m -62.18 -44.33 96.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.514 -179.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -72.67 -32.49 65.85 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.611 -178.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.12 -23.55 30.66 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.851 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 53.8 tp -84.01 -42.08 16.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.639 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.402 ' O ' HG13 ' A' ' 28' ' ' VAL . . . -60.0 -44.49 94.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.96 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.8 m120 -63.5 -38.64 91.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.874 0.369 . . . . 0.0 111.111 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -70.31 -38.7 75.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.078 -179.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.503 ' C ' HD13 ' A' ' 27' ' ' LEU . 2.6 tm? -66.32 -51.09 60.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.787 -179.207 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.402 HG13 ' O ' ' A' ' 24' ' ' ALA . 30.9 m -58.87 -21.72 19.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.247 -179.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -97.1 -24.67 15.64 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.939 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 73.2 m -95.03 18.82 11.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.171 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.9 t -59.91 -48.44 81.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.226 0.536 . . . . 0.0 109.786 179.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -50.89 -53.14 35.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.456 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -61.76 -40.08 93.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.029 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -51.55 -40.44 59.7 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.721 -0.391 . . . . 0.0 110.569 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -59.81 -40.1 96.25 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.51 -43.47 89.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.723 0.297 . . . . 0.0 110.549 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 79.2 mt -69.87 -43.41 79.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.529 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 63.2 tp -56.94 -47.0 81.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.008 0.433 . . . . 0.0 110.151 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.0 m -48.21 -31.71 6.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.84 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 71.1 m -93.6 35.21 1.13 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.849 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.0 t -92.26 34.8 1.02 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.657 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -90.78 22.64 3.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.767 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 p -89.53 19.81 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.785 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 103.63 -13.32 53.93 Favored Glycine 0 CA--C 1.529 0.955 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 88.3 p -91.72 24.5 3.1 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.735 0.302 . . . . 0.0 110.686 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -97.8 26.59 5.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.589 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.49 24.94 2.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.719 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 30.5 p90 -116.34 22.74 12.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.72 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -59.86 155.89 29.25 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -61.6 -36.1 79.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.805 0.336 . . . . 0.0 110.624 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.3 ptt-85 -59.44 -14.91 14.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.146 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.8 t30 -79.98 -32.96 39.81 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.726 0.298 . . . . 0.0 110.571 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.463 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -57.81 -47.3 83.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.791 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 14.7 p -69.99 -31.13 46.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.67 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -64.4 -46.81 81.65 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.649 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 13.2 p -76.69 -31.93 20.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.96 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.463 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.8 OUTLIER -55.47 -48.63 74.23 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 121.005 -0.278 . . . . 0.0 110.901 -179.987 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -65.7 -38.56 89.56 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.3 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -63.84 -23.17 67.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.723 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -108.07 80.43 1.07 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.731 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -66.05 -6.48 14.58 Favored 'Trans proline' 0 N--CA 1.494 1.548 0 C-N-CA 122.456 2.104 . . . . 0.0 112.556 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.6 tt -57.18 -41.66 79.7 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.308 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 31.8 p-10 -70.6 -19.12 62.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.725 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -74.57 -38.44 62.68 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.621 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.6 mt -71.65 159.07 86.56 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.39 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -53.98 141.62 67.11 Favored 'Trans proline' 0 N--CA 1.494 1.509 0 C-N-CA 122.396 2.064 . . . . 0.0 112.065 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 mt . . . . . 0 C--O 1.22 -0.45 0 CA-C-O 117.982 -1.009 . . . . 0.0 110.565 179.955 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.13 156.43 46.96 Favored 'Trans proline' 0 C--N 1.309 -1.525 0 C-N-CA 122.623 2.215 . . . . 0.0 112.243 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.1 tp -49.57 143.04 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.556 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 -114.86 174.0 6.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.588 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.3 p -69.59 161.61 29.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.56 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.6 p-80 -107.46 28.06 8.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.543 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -58.83 133.36 55.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.573 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.0 p -136.14 141.95 40.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.597 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.45 59.4 1.1 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.545 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -61.03 160.34 10.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.521 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.24 165.32 28.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.768 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.1 ptpp? -75.84 149.8 37.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.568 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.8 m -74.6 69.09 1.7 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.728 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 48.0 p30 -112.05 30.78 6.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.456 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.3 t -142.03 151.89 42.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.434 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.6 -20.83 58.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.148 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 95.8 m -62.0 -39.23 91.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.753 0.311 . . . . 0.0 110.826 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 50.8 t -59.37 -49.59 77.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.619 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.75 -43.36 96.68 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.731 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 79.6 m -47.6 -42.43 23.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.458 -179.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -82.94 -26.24 31.58 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.25 -28.08 53.5 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.529 -0.469 . . . . 0.0 111.543 -179.046 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.6 pp -84.65 -32.69 23.52 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.636 179.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.0 -47.71 84.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.968 -179.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -64.91 -40.25 94.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.822 0.344 . . . . 0.0 111.032 -179.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -65.09 -37.79 88.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.96 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.487 ' C ' HD13 ' A' ' 27' ' ' LEU . 2.2 tm? -66.65 -57.77 6.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.577 -179.449 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.1 m -54.18 -21.27 5.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.203 -179.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -97.08 -28.35 14.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.837 0.351 . . . . 0.0 110.855 -179.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.2 t -97.79 19.45 13.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.126 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 44.1 t -49.9 -48.8 51.36 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.919 0.39 . . . . 0.0 110.117 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -48.04 -51.62 23.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.346 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -59.5 -43.06 93.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.522 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -55.46 -44.11 76.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.853 0.358 . . . . 0.0 110.378 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -62.26 -40.65 99.28 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.734 -0.946 . . . . 0.0 110.734 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.62 -44.78 95.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.675 0.274 . . . . 0.0 110.961 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 82.0 mt -69.99 -46.98 71.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.963 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.417 HD11 ' OH ' ' A' ' 48' ' ' TYR . 49.4 tp -59.23 -45.1 92.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.007 0.432 . . . . 0.0 110.439 -179.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 69.5 m -51.21 -25.63 5.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.859 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 68.4 m -91.53 33.09 1.02 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.745 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.7 t -91.98 34.11 1.03 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.646 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -92.73 24.89 3.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.702 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.4 ' O ' HG22 ' A' ' 43' ' ' VAL . 5.4 p -91.41 23.83 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.954 0.407 . . . . 0.0 110.556 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 88.29 20.85 47.32 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 80.7 p -121.5 25.75 9.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.783 0.325 . . . . 0.0 110.556 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.6 p-10 -98.08 26.6 5.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.644 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -90.98 26.31 2.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.843 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.417 ' OH ' HD11 ' A' ' 38' ' ' LEU . 48.7 p90 -123.91 21.09 9.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.714 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -65.45 159.25 45.26 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -63.91 -28.03 69.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.845 0.355 . . . . 0.0 110.575 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 34.9 ptt-85 -62.39 -14.2 37.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.124 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -82.7 -30.76 28.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.733 0.302 . . . . 0.0 110.698 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.456 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -58.89 -43.77 91.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.914 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.7 p -75.05 -29.74 22.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.772 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -61.63 -49.59 75.95 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.805 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.1 p -71.45 -37.68 65.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.677 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.456 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -48.83 -51.43 29.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.975 179.968 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 40.3 mmtm -65.98 -38.21 87.97 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.594 -0.443 . . . . 0.0 110.484 -179.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -67.94 -22.62 65.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.841 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -107.33 82.31 1.2 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.724 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -65.48 -6.81 14.38 Favored 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.354 2.036 . . . . 0.0 112.579 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.0 tt -57.48 -42.41 82.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.796 0.332 . . . . 0.0 110.2 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 34.8 p-10 -74.22 -15.26 61.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.836 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -74.7 -29.56 61.24 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.746 0.308 . . . . 0.0 110.615 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.3 mt -70.89 158.7 87.51 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.274 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -52.96 140.1 59.58 Favored 'Trans proline' 0 N--CA 1.493 1.487 0 C-N-CA 122.363 2.042 . . . . 0.0 112.094 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.562 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -73.89 156.12 48.16 Favored 'Trans proline' 0 C--N 1.309 -1.516 0 C-N-CA 122.615 2.21 . . . . 0.0 112.24 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.3 tp -51.4 147.45 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.603 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -62.96 155.14 28.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.687 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 80.2 p -79.14 167.97 20.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.617 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 31.9 p80 -67.56 -22.84 65.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.824 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -61.22 135.38 57.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.653 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.6 p -137.36 144.11 32.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.539 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.25 72.94 1.39 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.607 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.05 164.21 0.89 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.609 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.13 170.76 15.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.553 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.4 pttp -65.59 139.56 58.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.613 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.86 88.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.605 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 16.9 p30 -108.05 -28.84 9.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.912 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.513 HG23 ' H ' ' A' ' 18' ' ' CYS . 1.8 t -48.94 145.25 4.04 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.87 0.366 . . . . 0.0 110.669 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.73 -23.69 67.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.512 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 96.8 m -70.34 -43.88 69.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.796 0.332 . . . . 0.0 110.827 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.513 ' H ' HG23 ' A' ' 15' ' ' THR . 22.2 t -62.45 -44.35 96.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.458 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.13 -37.77 88.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.707 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.441 ' HA ' HD21 ' A' ' 23' ' ' LEU . 97.7 m -47.98 -43.45 29.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.199 -179.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -72.14 -26.63 62.18 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.825 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -73.52 -49.61 25.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.763 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.441 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.6 pp -73.05 -33.05 65.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.596 -179.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.26 -46.39 86.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.808 0.337 . . . . 0.0 110.368 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -60.7 -41.57 95.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.568 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -63.15 -38.65 92.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.736 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.54 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -54.65 -62.03 1.92 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.001 0.429 . . . . 0.0 110.048 -179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.54 ' N ' HD13 ' A' ' 27' ' ' LEU . 27.8 m -63.62 -18.75 22.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.177 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -86.41 -19.46 29.64 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.024 -179.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.4 t -85.7 19.07 2.58 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.344 -179.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.1 t -61.95 -38.24 87.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.173 0.511 . . . . 0.0 110.523 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 7.7 p-10 -72.9 -51.87 16.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.454 -0.793 . . . . 0.0 111.171 -179.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -61.14 -44.3 97.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.993 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -46.07 -57.13 4.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.67 -179.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -64.37 -36.34 93.07 Favored Glycine 0 CA--C 1.526 0.732 0 C-N-CA 120.866 -0.683 . . . . 0.0 111.528 -179.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.89 -40.83 96.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.636 0.255 . . . . 0.0 110.874 -179.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.0 mt -74.17 -42.74 51.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.769 0.319 . . . . 0.0 110.71 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 65.4 tp -59.46 -50.42 74.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.143 0.497 . . . . 0.0 110.056 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.3 m -50.15 -26.9 5.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.786 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.9 m -92.16 29.49 1.63 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.732 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.2 t -59.25 -18.78 40.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.939 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 45.5 p-10 -82.11 8.89 9.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.308 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -89.02 18.42 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-O 120.717 0.294 . . . . 0.0 110.823 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 124.83 -20.45 6.79 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 111.139 -0.784 . . . . 0.0 111.139 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 70.0 p -98.48 34.12 2.09 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.81 0.338 . . . . 0.0 110.57 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -82.84 10.18 8.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.311 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.5 m -92.9 28.48 2.07 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.82 0.343 . . . . 0.0 110.516 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 12.2 p90 -101.87 19.87 17.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.904 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.92 126.61 22.39 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -71.06 -25.79 62.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.783 0.325 . . . . 0.0 110.615 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.3 ptt-85 -68.08 -19.31 64.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.001 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.91 -30.83 62.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.742 0.305 . . . . 0.0 110.691 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.464 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -59.34 -40.45 86.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.072 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -71.9 -29.84 34.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.904 -179.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -61.13 -51.3 69.69 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.701 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.428 HG13 ' N ' ' A' ' 57' ' ' LEU . 9.1 p -70.53 -41.81 78.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.495 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.464 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -50.11 -50.73 47.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.895 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm -69.3 -28.1 65.97 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.463 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -61.03 -25.82 67.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.591 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -119.04 75.78 14.53 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.531 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -66.37 -7.36 17.37 Favored 'Trans proline' 0 C--N 1.308 -1.588 0 C-N-CA 122.554 2.17 . . . . 0.0 112.494 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.3 tt -66.76 -36.94 83.62 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.271 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -84.73 -24.51 28.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.557 179.611 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 94.2 t80 -84.82 -24.9 28.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.691 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 64.4 mt -86.75 159.7 51.64 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.365 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -53.09 141.0 59.22 Favored 'Trans proline' 0 N--CA 1.494 1.537 0 C-N-CA 122.392 2.061 . . . . 0.0 112.081 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 15.5 mt . . . . . 0 C--O 1.22 -0.477 0 CA-C-O 117.941 -1.028 . . . . 0.0 110.592 179.992 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -74.44 154.04 45.11 Favored 'Trans proline' 0 C--N 1.308 -1.577 0 C-N-CA 122.588 2.192 . . . . 0.0 112.211 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.7 tp -58.23 135.87 22.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.511 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -65.79 160.19 23.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.588 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 68.1 m -64.46 149.49 48.41 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.543 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.3 p80 -62.15 -24.8 67.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.727 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 54.5 tt0 -97.48 130.87 44.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.575 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.5 p -135.52 141.64 41.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.575 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -149.83 70.05 1.04 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.695 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 63.6 pttt -139.04 155.5 47.91 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.598 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 95.4 mtm-85 -73.3 145.84 45.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.626 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -75.28 142.64 43.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.634 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 52.9 m 31.8 74.3 0.05 Allowed 'General case' 0 N--CA 1.47 0.568 0 O-C-N 124.163 0.915 . . . . 0.0 112.224 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -103.6 30.44 5.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.659 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.8 t -148.84 147.85 29.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.686 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.61 -20.62 34.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.124 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 97.7 m -59.4 -40.08 85.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.772 0.32 . . . . 0.0 110.704 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 54.0 t -59.22 -44.3 92.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.662 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.36 -41.94 97.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.614 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 98.7 m -59.95 -45.85 91.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.745 -179.259 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -78.85 -29.83 44.84 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.779 -178.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.12 -22.65 33.31 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.185 -179.633 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 52.3 tp -83.6 -41.89 17.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.799 0.333 . . . . 0.0 110.54 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.45 -43.64 93.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.867 -179.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -63.06 -39.21 94.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.812 0.339 . . . . 0.0 111.0 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -66.03 -39.55 90.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.138 -179.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.504 ' C ' HD13 ' A' ' 27' ' ' LEU . 2.5 tm? -65.78 -52.16 53.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.772 -179.267 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.6 m -59.24 -21.74 20.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.186 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -96.01 -25.9 15.75 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.871 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.7 t -100.86 19.22 17.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.135 -179.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 41.7 t -53.21 -51.33 62.47 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.922 0.391 . . . . 0.0 110.114 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -47.93 -53.37 16.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.557 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -60.5 -40.76 92.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.661 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -55.88 -39.52 71.67 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.395 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -60.95 -40.9 99.06 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.52 -1.032 . . . . 0.0 110.52 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.78 -43.89 85.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.746 0.308 . . . . 0.0 110.746 -179.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.8 mt -67.98 -43.98 85.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.731 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.404 ' O ' HG22 ' A' ' 41' ' ' THR . 60.7 tp -58.73 -48.65 80.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.893 0.377 . . . . 0.0 110.425 -179.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 68.8 m -49.02 -32.12 8.79 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.747 -179.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.5 m -94.97 35.85 1.24 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.838 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.404 HG22 ' O ' ' A' ' 38' ' ' LEU . 13.8 t -91.67 33.19 1.03 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.734 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.8 p-10 -86.87 14.62 6.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.06 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.1 p -64.76 -22.72 31.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.755 0.312 . . . . 0.0 110.766 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 148.53 -17.82 1.29 Allowed Glycine 0 CA--C 1.528 0.855 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 84.9 p -92.45 26.89 2.44 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.739 0.304 . . . . 0.0 110.542 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -92.3 25.81 2.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.598 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.12 28.41 1.89 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.689 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -117.34 23.93 11.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.695 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -55.43 145.7 31.09 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.009 -0.837 . . . . 0.0 111.009 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.2 mtmm -62.78 -37.88 88.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.77 0.319 . . . . 0.0 110.717 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.3 ptt-85 -62.88 -17.34 61.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.112 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -74.03 -28.79 61.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.804 0.335 . . . . 0.0 110.705 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.467 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -58.71 -41.45 86.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.931 -179.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -73.04 -30.93 33.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.814 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -63.39 -50.75 68.65 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.643 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.412 HG13 ' N ' ' A' ' 57' ' ' LEU . 9.9 p -68.94 -39.19 79.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.601 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.467 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -53.26 -51.34 62.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.068 179.958 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -69.61 -35.47 75.3 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.532 -179.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.8 tmt_? -61.78 -28.92 69.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.658 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -113.4 75.16 2.29 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.75 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -68.35 -5.96 16.32 Favored 'Trans proline' 0 C--N 1.307 -1.63 0 C-N-CA 122.703 2.269 . . . . 0.0 112.548 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.7 tt -62.36 -41.09 98.33 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.896 0.379 . . . . 0.0 110.267 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -63.8 -32.87 74.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.253 179.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -74.9 -38.47 61.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.689 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.7 mt -68.34 159.1 82.5 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.436 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -53.79 143.37 59.34 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 122.424 2.083 . . . . 0.0 112.18 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 13.3 mt . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 117.982 -1.009 . . . . 0.0 110.569 179.915 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -71.7 153.1 59.49 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 C-N-CA 122.246 1.964 . . . . 0.0 112.189 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.6 tp -57.96 140.72 15.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.592 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -61.36 158.97 13.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.552 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.6 p -69.95 159.42 33.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.589 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.2 p80 -103.04 23.37 12.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.686 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 -66.04 133.87 51.69 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.481 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.7 p -130.48 138.58 53.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.58 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.66 66.56 1.26 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.519 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.91 142.46 9.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.511 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.21 170.94 15.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.665 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -58.79 140.25 55.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.717 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.1 m -72.51 84.98 1.13 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.665 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -99.23 -44.13 6.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.638 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.9 t -47.15 153.17 0.48 Allowed 'General case' 0 C--O 1.231 0.113 0 CA-C-O 120.892 0.377 . . . . 0.0 110.991 -179.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.95 -15.15 62.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.468 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 98.3 m -68.29 -44.48 75.4 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.832 0.349 . . . . 0.0 110.687 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 10.2 t -63.38 -43.09 98.58 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.348 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.07 -36.31 82.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.85 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.431 ' HA ' HD21 ' A' ' 23' ' ' LEU . 64.5 m -49.12 -43.87 41.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.208 -179.448 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -73.47 -26.53 60.95 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.786 -0.366 . . . . 0.0 111.139 -179.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -75.83 -39.82 55.99 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.91 -0.316 . . . . 0.0 111.017 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.431 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.4 pp -84.01 -30.45 26.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.6 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.69 -47.67 84.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.475 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.3 m-20 -64.21 -40.39 95.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.725 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -64.34 -36.84 85.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.724 -179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.528 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -53.29 -61.82 2.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.182 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.528 ' N ' HD13 ' A' ' 27' ' ' LEU . 27.1 m -64.42 -19.81 25.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.339 -179.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -95.39 -0.3 52.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.655 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.9 t -118.2 16.22 14.04 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.137 -0.225 . . . . 0.0 110.872 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.9 t -64.51 -44.55 90.56 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.223 0.535 . . . . 0.0 110.41 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -58.66 -59.63 5.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.893 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -60.51 -42.19 95.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.987 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -50.16 -43.93 52.43 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.939 -0.304 . . . . 0.0 110.932 -179.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -60.81 -37.82 94.27 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.21 -42.14 90.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.587 -0.307 . . . . 0.0 110.514 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.6 mt -69.09 -42.1 81.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.499 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 63.1 tp -58.89 -52.23 66.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.092 0.472 . . . . 0.0 109.922 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.3 t -51.67 -26.2 8.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.546 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.2 m -91.98 28.6 1.8 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.643 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.424 HG23 ' O ' ' A' ' 41' ' ' THR . 9.7 t -85.94 46.98 1.38 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.809 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 -90.66 21.43 4.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.833 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 p -90.16 20.5 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.718 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 85.14 20.99 56.4 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 61.3 p -119.64 29.41 7.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.773 0.321 . . . . 0.0 110.547 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -96.08 26.89 3.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.556 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.8 m -91.98 28.45 1.84 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.678 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.411 ' HE2' HG21 ' A' ' 41' ' ' THR . 41.2 p90 -113.98 22.64 13.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.708 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -64.6 160.44 40.8 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.049 -0.82 . . . . 0.0 111.049 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm -63.16 -31.43 72.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.822 0.344 . . . . 0.0 110.691 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.1 ptt-85 -57.96 -16.48 12.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.024 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -79.85 -26.62 40.32 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.688 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.467 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -59.73 -51.74 68.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.902 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 4.8 p -66.09 -30.29 49.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.563 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -64.67 -47.67 77.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.664 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.95 -29.56 15.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.994 -179.682 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.467 HD13 ' O ' ' A' ' 53' ' ' ALA . 1.5 mp -59.67 -44.25 93.66 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.876 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -66.79 -38.86 87.36 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.273 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -63.78 -25.21 68.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.345 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -108.67 80.48 1.23 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.368 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -65.08 -7.11 14.42 Favored 'Trans proline' 0 N--CA 1.494 1.556 0 C-N-CA 122.457 2.105 . . . . 0.0 112.771 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.0 tt -58.37 -41.04 83.88 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.377 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 -71.34 -13.9 62.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.917 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -74.53 -34.4 63.0 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.884 0.373 . . . . 0.0 110.404 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.1 mt -73.15 159.01 86.13 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.382 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -53.05 139.33 61.83 Favored 'Trans proline' 0 N--CA 1.493 1.48 0 C-N-CA 122.386 2.057 . . . . 0.0 112.056 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 C--O 1.22 -0.494 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.559 179.95 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -73.48 160.74 43.9 Favored 'Trans proline' 0 C--N 1.309 -1.527 0 C-N-CA 122.633 2.222 . . . . 0.0 112.272 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.5 tp -49.31 135.82 6.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.608 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -70.6 168.87 15.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.705 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.0 p -71.92 171.08 12.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.508 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.3 p80 -51.04 -28.1 9.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.499 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 41.9 tt0 -70.9 131.1 43.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.408 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.7 p -136.96 141.64 39.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.626 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.6 61.34 1.51 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.38 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -56.29 152.11 11.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.675 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.9 177.77 8.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.5 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -126.1 155.3 41.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.603 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 49.0 m 32.11 79.86 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 O-C-N 124.094 0.871 . . . . 0.0 112.186 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 23.2 p30 -103.51 30.47 4.97 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.49 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 10.6 t -146.03 149.64 34.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.684 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.91 -22.09 65.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.211 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 97.4 m -60.29 -39.2 86.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.927 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 50.4 t -58.94 -48.28 82.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.764 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.63 -43.65 98.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.726 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.3 m -48.58 -42.86 35.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.305 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -82.95 -26.35 31.46 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -179.232 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.48 -27.79 61.58 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.616 -0.434 . . . . 0.0 111.55 -179.046 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.4 pp -84.51 -29.24 26.14 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.701 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.1 -50.27 74.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.67 -179.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -63.59 -42.52 98.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.919 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -62.13 -39.15 91.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.946 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.517 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.9 tm? -66.56 -61.53 1.93 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.546 -179.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.517 ' N ' HD13 ' A' ' 27' ' ' LEU . 24.3 m -55.46 -20.97 8.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.294 -179.596 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -97.13 -21.85 17.09 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.225 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.2 t -97.19 19.1 13.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.28 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 41.5 t -55.42 -53.05 61.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.035 0.445 . . . . 0.0 109.848 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -48.01 -51.23 24.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.44 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -61.3 -40.13 93.01 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.841 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -53.47 -39.05 64.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.777 0.322 . . . . 0.0 110.637 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.98 -43.87 96.78 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 110.569 -1.012 . . . . 0.0 110.569 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.34 -43.14 92.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.711 0.291 . . . . 0.0 110.818 -179.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.5 mt -66.56 -47.59 83.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.879 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.404 ' O ' HG22 ' A' ' 41' ' ' THR . 63.3 tp -58.97 -45.64 90.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.897 0.379 . . . . 0.0 110.51 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 71.1 m -49.52 -29.77 7.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.729 -179.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 68.5 m -94.06 34.13 1.28 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.739 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.404 HG22 ' O ' ' A' ' 38' ' ' LEU . 14.5 t -92.6 31.18 1.39 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.617 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 43.3 p-10 -94.06 23.49 4.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.741 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 p -89.34 19.71 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.806 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 112.05 -18.61 23.69 Favored Glycine 0 CA--C 1.527 0.792 0 N-CA-C 111.192 -0.763 . . . . 0.0 111.192 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 87.3 p -92.06 24.9 3.06 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.809 0.337 . . . . 0.0 110.63 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 50.3 p-10 -96.58 26.89 4.14 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.652 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.4 m -87.94 19.51 3.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.068 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 12.9 p90 -116.71 22.44 12.69 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.799 0.333 . . . . 0.0 110.55 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -58.79 153.93 28.54 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -61.79 -36.23 80.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.792 0.329 . . . . 0.0 110.692 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.2 ptt-85 -59.91 -15.56 22.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.98 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -80.25 -35.0 36.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.756 0.312 . . . . 0.0 110.547 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.414 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -58.99 -44.64 91.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.762 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 14.5 p -71.84 -32.16 43.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.638 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -62.09 -50.7 70.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.678 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 11.2 p -72.03 -32.77 45.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.928 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.414 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -53.77 -45.61 70.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.92 179.945 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -67.91 -40.46 83.4 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.39 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -63.55 -24.42 67.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.623 179.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -108.0 79.5 0.91 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.432 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -64.6 -7.67 15.19 Favored 'Trans proline' 0 N--CA 1.494 1.528 0 C-N-CA 122.361 2.041 . . . . 0.0 112.584 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.5 tt -63.81 -42.52 97.67 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.159 179.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -82.53 -5.18 58.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.957 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -74.5 -35.12 63.21 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-O 120.823 0.344 . . . . 0.0 110.489 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.3 mt -88.49 159.18 47.53 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.292 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -53.49 140.43 64.39 Favored 'Trans proline' 0 N--CA 1.494 1.507 0 C-N-CA 122.319 2.013 . . . . 0.0 112.093 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.22 -0.463 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.588 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -74.09 155.25 47.48 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.612 2.208 . . . . 0.0 112.223 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.8 tp -52.51 136.82 12.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.531 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -68.77 156.9 37.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.595 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 82.8 p -69.87 159.69 33.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.53 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 31.7 p80 -109.63 22.27 15.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.777 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -71.56 132.08 44.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.542 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.4 p -78.12 133.84 29.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.645 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.11 65.63 1.15 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.494 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.08 160.02 1.1 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.632 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.93 149.33 35.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.542 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.461 ' HZ3' ' HB3' ' A' ' 14' ' ' ASN . 23.6 pttp -72.78 145.44 47.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.906 -179.655 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.15 94.2 0.88 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.685 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.461 ' HB3' ' HZ3' ' A' ' 12' ' ' LYS . 12.8 p30 -125.66 -40.41 2.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.892 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.2 t -53.52 152.1 5.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.929 0.395 . . . . 0.0 110.878 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.62 -19.72 64.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.356 -179.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 92.3 m -65.03 -37.16 86.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.82 0.343 . . . . 0.0 110.706 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.0 t -59.41 -45.56 91.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.655 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.78 -39.18 90.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.725 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.446 ' HA ' HD21 ' A' ' 23' ' ' LEU . 59.4 m -47.32 -43.58 22.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.385 -179.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -77.14 -26.91 53.65 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.804 -0.358 . . . . 0.0 111.043 -179.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.7 tpp85 -69.26 -50.11 50.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.761 0.315 . . . . 0.0 110.53 -179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.446 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.5 pp -70.59 -31.72 68.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.65 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.81 -48.81 77.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.533 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -66.88 -40.13 87.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.868 0.366 . . . . 0.0 110.535 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -62.37 -27.77 69.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.908 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.516 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.8 tm? -64.46 -61.89 1.94 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.872 0.368 . . . . 0.0 110.254 -179.749 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.516 ' N ' HD13 ' A' ' 27' ' ' LEU . 19.7 m -70.67 -18.51 21.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.367 -179.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -82.18 -38.02 25.25 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.843 0.354 . . . . 0.0 110.889 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.88 19.13 18.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.203 -179.536 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.7 t -55.78 -49.35 73.39 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.129 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -50.58 -54.4 22.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.132 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -56.56 -45.83 81.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.629 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -53.55 -53.34 53.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.746 0.308 . . . . 0.0 111.124 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -67.38 -33.87 83.36 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.204 -0.758 . . . . 0.0 111.204 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.29 -42.88 99.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.735 0.302 . . . . 0.0 110.793 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.4 mt -66.09 -44.49 91.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.951 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.3 tp -65.27 -42.49 93.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.95 0.405 . . . . 0.0 110.12 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.8 m -58.89 -36.88 75.38 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.577 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 67.9 m -91.64 35.76 0.95 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.667 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.413 HG21 ' CZ ' ' A' ' 48' ' ' TYR . 9.1 t -56.62 -17.73 9.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.038 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.1 p-10 -79.32 5.01 13.53 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.359 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.6 p -88.58 16.53 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.01 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 148.14 -27.69 1.4 Allowed Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 5.9 p -99.22 34.08 2.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.849 0.357 . . . . 0.0 110.44 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.8 p-10 -63.88 -10.72 22.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.383 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -90.7 28.05 1.62 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.782 0.325 . . . . 0.0 110.818 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.413 ' CZ ' HG21 ' A' ' 41' ' ' THR . 13.8 p90 -90.01 20.01 4.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.846 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -48.04 102.6 0.05 OUTLIER Glycine 0 CA--C 1.525 0.662 0 N-CA-C 111.141 -0.783 . . . . 0.0 111.141 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.9 mtmm -79.4 -20.12 48.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.718 0.294 . . . . 0.0 110.83 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.4 ptt-85 -58.73 -15.82 13.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.139 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -74.93 -24.97 58.58 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.765 0.317 . . . . 0.0 110.749 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.459 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -58.02 -44.47 87.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.073 -179.574 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 1.6 p -77.31 -30.38 17.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.728 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -65.26 -46.34 80.92 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.791 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.407 HG13 ' N ' ' A' ' 57' ' ' LEU . 13.6 p -71.67 -38.51 66.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 120.85 -0.34 . . . . 0.0 110.577 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.459 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -49.56 -54.71 16.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.791 -179.982 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -64.3 -31.69 73.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.698 -179.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -62.71 -37.51 86.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.659 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -115.65 76.61 5.73 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.618 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -67.4 -13.03 37.92 Favored 'Trans proline' 0 C--N 1.308 -1.581 0 C-N-CA 122.7 2.267 . . . . 0.0 112.48 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 25.5 tp -58.81 -42.69 89.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.774 0.321 . . . . 0.0 110.402 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -50.7 -35.66 32.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.495 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 91.3 t80 -75.51 -47.91 24.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.69 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.7 mt -72.18 159.28 85.84 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.373 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -53.77 141.08 66.42 Favored 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.355 2.036 . . . . 0.0 112.041 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.221 -0.443 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.58 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -74.31 152.94 45.11 Favored 'Trans proline' 0 C--N 1.309 -1.539 0 C-N-CA 122.554 2.169 . . . . 0.0 112.196 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.8 tp -63.46 140.85 18.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.576 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -60.18 142.14 54.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.562 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.3 p -71.98 160.77 31.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.565 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 33.0 p80 -63.82 -24.13 67.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.672 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -67.77 139.22 56.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.619 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 8.7 p -128.09 142.04 44.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.567 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.92 77.33 1.62 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.571 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.13 165.87 10.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.376 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.02 168.43 19.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.691 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -60.78 145.6 49.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.77 -179.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -69.7 84.55 0.46 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.59 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -108.52 -37.78 5.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.603 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.451 HG23 ' H ' ' A' ' 18' ' ' CYS . 14.8 t -49.88 150.96 1.99 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.342 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.14 -15.68 63.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.708 -179.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 95.5 m -69.34 -40.41 77.58 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.984 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.451 ' H ' HG23 ' A' ' 15' ' ' THR . 15.5 t -64.49 -49.25 72.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.831 -179.533 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.56 -40.76 96.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.916 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.424 ' HA ' HD23 ' A' ' 23' ' ' LEU . 9.1 m -48.91 -34.46 12.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.228 -179.396 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -80.44 -26.26 38.48 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.571 -179.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.8 -25.65 60.22 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.544 -0.462 . . . . 0.0 111.288 -179.196 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' A' ' 20' ' ' THR . 1.5 pp -84.36 -26.38 28.46 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.567 179.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.39 -51.37 69.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.827 0.346 . . . . 0.0 110.486 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -64.29 -40.3 95.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.667 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -63.92 -36.71 84.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.646 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.555 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -56.1 -62.46 1.69 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.149 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.555 ' N ' HD13 ' A' ' 27' ' ' LEU . 25.7 m -66.45 -19.21 25.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.311 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -84.98 -13.18 51.45 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.322 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.8 t -85.72 19.03 2.6 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 121.098 -0.241 . . . . 0.0 111.248 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.6 t -60.59 -37.37 81.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.961 0.41 . . . . 0.0 110.774 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.3 p-10 -81.79 -50.16 9.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.237 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.439 ' O ' HD12 ' A' ' 37' ' ' ILE . 28.0 m120 -59.04 -44.24 91.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.109 -179.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -45.25 -56.31 4.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.484 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.27 -31.4 80.6 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 111.007 -0.837 . . . . 0.0 111.007 -179.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.27 -42.72 96.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.665 0.269 . . . . 0.0 110.674 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.439 HD12 ' O ' ' A' ' 33' ' ' ASN . 1.6 mp -70.2 -44.07 78.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.69 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.425 HD11 ' OH ' ' A' ' 48' ' ' TYR . 62.9 tp -60.81 -50.55 73.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.277 0.561 . . . . 0.0 109.833 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 71.2 m -48.9 -29.21 4.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.638 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.411 ' O ' HG12 ' A' ' 43' ' ' VAL . 56.3 m -90.97 36.0 0.91 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.75 -179.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.8 t -56.27 -21.69 25.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.901 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.0 p-10 -83.2 9.83 9.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.313 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.411 HG12 ' O ' ' A' ' 40' ' ' SER . 6.6 p -84.93 -21.57 7.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.761 0.315 . . . . 0.0 110.677 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 129.4 22.69 1.18 Allowed Glycine 0 CA--C 1.528 0.85 0 N-CA-C 111.079 -0.809 . . . . 0.0 111.079 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 84.5 p -124.59 33.91 5.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.844 0.354 . . . . 0.0 110.417 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 48.9 p30 -92.13 26.84 2.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.759 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.7 m -91.3 27.61 1.88 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.836 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.425 ' OH ' HD11 ' A' ' 38' ' ' LEU . 35.5 p90 -126.07 25.65 6.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.629 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.1 123.92 12.21 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -65.92 -36.73 84.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.775 0.321 . . . . 0.0 110.701 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 7.1 ptp180 -63.1 -19.2 64.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.034 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -74.29 -29.79 61.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.802 0.334 . . . . 0.0 110.653 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.468 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -58.72 -41.48 86.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.032 -179.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -71.91 -29.84 34.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.856 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -60.77 -52.2 66.09 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.606 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.408 HG13 ' N ' ' A' ' 57' ' ' LEU . 10.3 p -70.17 -39.72 77.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.56 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.468 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -53.53 -46.3 70.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.91 179.876 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -66.82 -39.48 87.71 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.374 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -66.04 -24.79 66.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.505 179.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -105.83 85.48 1.55 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.509 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -63.68 -8.19 14.76 Favored 'Trans proline' 0 N--CA 1.495 1.573 0 C-N-CA 122.25 1.967 . . . . 0.0 112.67 -179.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.4 tt -59.28 -42.38 91.11 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.24 179.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -78.63 -10.43 59.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.008 179.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -74.43 -39.13 62.79 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.797 0.332 . . . . 0.0 110.543 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.3 mt -72.24 158.76 86.99 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.297 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -52.44 137.79 56.97 Favored 'Trans proline' 0 N--CA 1.494 1.503 0 C-N-CA 122.321 2.014 . . . . 0.0 112.036 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.9 mt . . . . . 0 C--O 1.22 -0.49 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.542 -179.987 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -74.28 153.34 45.53 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.542 2.161 . . . . 0.0 112.185 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.8 tp -64.37 141.12 18.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.546 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -59.97 144.17 49.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.633 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.1 p -72.07 163.39 27.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.642 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.1 p-80 -102.35 23.66 11.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.699 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 54.2 tt0 -88.37 132.68 34.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.534 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.0 p -130.09 142.87 42.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.528 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.94 68.78 1.3 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.555 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -54.89 156.2 3.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.511 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.28 166.6 25.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.605 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.0 ptpp? -61.46 151.54 32.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.725 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.5 m -74.62 69.01 1.71 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.739 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 48.2 p30 -113.01 23.89 12.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.837 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.6 t -130.7 154.11 48.27 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.458 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.04 -19.89 55.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.259 -179.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 98.1 m -63.21 -41.68 99.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.754 0.311 . . . . 0.0 110.896 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 44.1 t -60.35 -45.45 93.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.609 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.4 -40.62 97.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.729 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.458 ' HA ' HD21 ' A' ' 23' ' ' LEU . 84.8 m -45.79 -42.76 12.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.454 -179.36 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -82.1 -26.63 33.42 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.953 -179.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.5 tpp85 -66.97 -49.65 64.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.749 0.309 . . . . 0.0 110.708 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.458 HD21 ' HA ' ' A' ' 20' ' ' THR . 2.6 pp -64.56 -32.64 74.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.499 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.66 -44.36 90.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.492 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -64.39 -40.79 96.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.937 0.399 . . . . 0.0 110.529 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -62.04 -33.68 74.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.903 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.533 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -58.88 -62.09 2.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.118 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.533 ' N ' HD13 ' A' ' 27' ' ' LEU . 29.2 m -64.48 -18.42 23.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.357 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -86.44 -28.32 23.58 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.023 -179.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.2 t -96.49 19.21 12.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.244 -179.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 40.4 t -55.53 -56.72 17.03 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.283 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -49.15 -50.18 38.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.408 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 28.3 m120 -58.24 -43.6 87.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.738 179.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -53.79 -50.07 66.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.724 0.297 . . . . 0.0 110.94 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -64.79 -39.44 96.61 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.88 -43.17 98.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.743 0.306 . . . . 0.0 110.802 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 80.1 mt -69.34 -44.54 80.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.883 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 62.1 tp -61.0 -44.17 97.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.985 0.421 . . . . 0.0 110.181 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.5 m -53.48 -34.78 59.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.607 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.1 m -91.08 35.71 0.91 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.675 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.8 t -57.3 -17.49 12.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.006 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 33.4 p-10 -53.86 -22.15 9.19 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.697 0.284 . . . . 0.0 110.784 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 9.8 p -52.55 -24.1 5.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.68 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 130.58 26.89 0.77 Allowed Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 78.9 p -122.77 28.65 7.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.743 0.306 . . . . 0.0 110.499 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 -93.15 21.63 5.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.807 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.0 m -92.98 28.55 2.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.818 0.342 . . . . 0.0 110.566 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 19.7 p90 -122.33 24.61 9.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.623 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -49.1 119.2 5.85 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -70.72 -25.46 62.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.765 0.317 . . . . 0.0 110.666 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -67.11 -18.67 65.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.015 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.25 -25.48 55.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.811 0.339 . . . . 0.0 110.702 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.37 -39.89 88.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.969 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -78.18 -30.14 15.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.639 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -62.77 -49.91 73.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.712 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.426 HG13 ' N ' ' A' ' 57' ' ' LEU . 8.8 p -66.82 -40.92 86.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.592 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.426 ' N ' HG13 ' A' ' 56' ' ' VAL . 0.4 OUTLIER -52.91 -51.89 59.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.96 -179.943 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -63.57 -22.21 66.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.831 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -67.28 -34.79 78.16 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.78 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -123.98 75.05 57.92 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.67 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -68.49 -19.92 42.23 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 122.737 2.292 . . . . 0.0 112.3 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.4 tt -60.89 -42.83 98.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.596 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.15 -32.81 74.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.747 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -74.73 -41.46 60.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.788 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.9 mt -64.64 159.23 62.93 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.426 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -53.43 141.38 61.73 Favored 'Trans proline' 0 N--CA 1.494 1.515 0 C-N-CA 122.417 2.078 . . . . 0.0 112.052 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.22 -0.496 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.556 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -72.95 159.12 48.72 Favored 'Trans proline' 0 C--N 1.309 -1.547 0 C-N-CA 122.561 2.174 . . . . 0.0 112.244 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.421 ' O ' HG23 ' A' ' 3' ' ' ILE . 8.8 tp -49.42 131.5 7.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.552 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -78.97 173.38 12.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.606 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 70.2 m -61.79 151.03 35.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.531 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.5 p80 -60.78 -25.39 66.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.632 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -89.68 88.41 7.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.56 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.0 p -139.56 146.05 25.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.512 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.05 157.82 45.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.685 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 26.1 pttm -139.16 159.75 41.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.573 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -119.34 133.15 55.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.451 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.1 pttp -64.96 138.66 58.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.54 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 11.9 m 32.07 80.05 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 O-C-N 124.082 0.864 . . . . 0.0 112.059 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.2 p30 -105.7 30.63 5.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.598 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.5 t -143.09 147.79 35.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.751 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.6 -26.61 65.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.161 -179.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 95.1 m -58.01 -38.68 76.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.98 -179.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 48.3 t -59.82 -45.04 93.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.862 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.68 -44.4 93.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.651 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 96.9 m -56.06 -43.99 78.47 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.19 -179.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -73.94 -56.14 5.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.722 -179.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.43 -27.58 64.45 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.348 -179.225 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.3 tp -71.52 -47.94 52.05 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.814 -0.355 . . . . 0.0 110.462 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.88 -42.27 93.37 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.95 -179.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -63.91 -39.36 93.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.838 0.351 . . . . 0.0 110.949 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -71.88 -36.44 70.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.959 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.485 ' C ' HD13 ' A' ' 27' ' ' LEU . 2.0 tm? -63.98 -59.44 4.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.55 -179.422 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.454 ' N ' HD13 ' A' ' 27' ' ' LEU . 35.8 m -51.08 -22.99 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.396 -179.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -94.75 -30.6 14.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.819 0.342 . . . . 0.0 110.896 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.4 t -99.31 19.51 15.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.192 -179.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.7 t -49.48 -50.38 41.59 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.778 0.323 . . . . 0.0 110.316 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 -46.93 -52.08 15.39 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.462 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 99.8 m-20 -56.98 -44.92 83.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.386 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -57.01 -45.69 82.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.823 0.344 . . . . 0.0 110.431 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -62.04 -49.69 72.82 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.41 -42.07 81.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.719 0.295 . . . . 0.0 110.908 -179.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 77.3 mt -63.87 -48.57 85.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.952 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.1 tp -62.97 -39.07 93.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.785 0.326 . . . . 0.0 110.555 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.2 t -49.58 -31.04 9.72 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.63 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 70.9 m -90.52 36.03 0.89 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.824 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.8 t -85.61 15.86 4.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.226 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -92.75 15.57 14.28 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.978 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.3 p -90.63 19.92 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 CA-C-O 120.785 0.326 . . . . 0.0 110.749 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 108.78 20.52 8.01 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 111.176 -0.769 . . . . 0.0 111.176 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 77.2 p -125.36 28.43 6.31 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.798 0.332 . . . . 0.0 110.479 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -94.37 22.07 6.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.855 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.4 m -93.65 26.26 3.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.627 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 20.1 p90 -118.8 22.43 11.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.803 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -48.94 108.0 0.36 Allowed Glycine 0 CA--C 1.525 0.66 0 N-CA-C 111.022 -0.831 . . . . 0.0 111.022 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -70.18 -27.25 64.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.79 0.329 . . . . 0.0 110.518 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -59.76 -18.69 45.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.933 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.98 -25.8 31.93 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.82 0.343 . . . . 0.0 110.583 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.457 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -61.41 -45.11 95.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.891 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 8.1 p -73.56 -30.61 30.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.6 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.2 tm-20 -64.26 -45.52 87.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.688 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 14.4 p -75.79 -31.73 23.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.722 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.457 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -61.58 -39.71 92.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.795 0.331 . . . . 0.0 110.626 179.768 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -62.2 -44.67 96.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.717 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -69.48 -38.47 77.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.648 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -76.1 157.31 83.41 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.449 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.46 -4.97 16.25 Favored 'Trans proline' 0 N--CA 1.493 1.492 0 C-N-CA 122.529 2.152 . . . . 0.0 112.692 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.5 tt -55.62 -42.43 74.9 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.862 0.363 . . . . 0.0 110.324 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 11.4 p-10 -77.75 -23.74 49.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.571 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -74.57 -35.4 63.03 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.689 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.2 mt -73.89 159.03 85.16 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.357 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -53.34 140.43 62.82 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 122.367 2.044 . . . . 0.0 112.053 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.22 -0.462 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.56 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -72.78 159.03 49.34 Favored 'Trans proline' 0 C--N 1.308 -1.58 0 C-N-CA 122.55 2.167 . . . . 0.0 112.153 -179.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.5 tp -49.58 140.29 3.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.548 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.0 pt-20 -57.04 175.64 0.13 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.655 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 66.4 m -63.31 162.78 11.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.601 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 17.5 p80 -68.61 -13.82 62.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.006 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.01 132.85 53.39 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.775 0.321 . . . . 0.0 110.363 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.2 p -122.78 146.22 28.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.659 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -147.14 162.25 39.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.539 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.2 pttt -130.61 152.03 50.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.584 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.27 163.43 34.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.521 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.6 ptpp? -82.5 134.37 35.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.541 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -53.27 95.15 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.056 -179.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -112.83 -36.12 5.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.017 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.471 HG23 ' H ' ' A' ' 18' ' ' CYS . 2.4 t -45.92 145.28 1.53 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.965 0.412 . . . . 0.0 111.096 -179.514 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.94 -21.25 66.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.169 -179.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 95.9 m -69.5 -40.86 76.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.815 0.34 . . . . 0.0 110.742 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.471 ' H ' HG23 ' A' ' 15' ' ' THR . 20.4 t -61.57 -46.7 88.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.647 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.31 -36.55 84.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.818 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.5 m -47.77 -41.88 24.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.09 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -76.22 -26.57 56.2 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.765 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 tpp85 -71.61 -44.08 65.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.853 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.6 pp -78.61 -30.42 46.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.803 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.48 -49.98 75.39 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.264 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -63.9 -38.6 91.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.417 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -62.79 -34.72 77.86 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.822 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.533 HD13 ' N ' ' A' ' 28' ' ' VAL . 1.7 tm? -57.84 -61.98 2.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.974 0.416 . . . . 0.0 110.107 -179.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.533 ' N ' HD13 ' A' ' 27' ' ' LEU . 34.2 m -67.6 -18.61 24.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.544 -179.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -87.61 -21.89 25.07 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.293 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.0 t -100.81 19.04 17.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.266 -179.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.2 t -62.36 -52.8 62.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.979 0.419 . . . . 0.0 110.618 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -54.41 -51.95 63.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.836 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -61.06 -42.88 99.31 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.767 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -48.9 -48.96 42.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.073 -179.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.4 -39.52 97.84 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 -179.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.36 -43.6 96.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.657 0.265 . . . . 0.0 111.1 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.3 mt -74.59 -43.72 47.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.031 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 65.7 tp -58.93 -48.59 80.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.934 0.397 . . . . 0.0 110.491 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.7 m -48.95 -27.32 3.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.719 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.9 m -90.76 36.12 0.9 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.695 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 6.3 t -86.37 45.64 1.26 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.732 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 48.1 p-10 -98.61 21.16 11.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.708 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -88.45 15.9 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.78 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 100.91 8.94 47.06 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 59.4 p -109.39 26.22 10.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.786 0.327 . . . . 0.0 110.514 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -92.5 24.5 3.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.652 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.46 23.48 3.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.715 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 21.6 p90 -106.9 18.78 21.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.596 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -52.16 142.4 23.22 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -61.77 -38.64 88.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.757 0.313 . . . . 0.0 110.599 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.0 ptt-85 -67.26 -16.09 64.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.057 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.93 -27.02 36.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.794 0.331 . . . . 0.0 110.617 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.3 -43.17 92.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.908 -179.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.2 p -75.48 -29.71 21.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.695 -179.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.5 tm-20 -63.58 -47.54 81.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.69 0.281 . . . . 0.0 110.842 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.6 p -72.75 -37.56 55.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.597 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.61 -51.82 65.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.92 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -69.3 -26.79 64.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.883 0.373 . . . . 0.0 110.557 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -67.66 -31.45 71.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.81 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -123.07 74.2 48.51 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.761 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -69.16 -8.23 23.02 Favored 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.821 2.347 . . . . 0.0 112.616 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.3 tt -64.73 -42.59 95.1 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.858 0.361 . . . . 0.0 110.443 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -57.74 -32.05 67.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.533 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -80.13 -43.78 21.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.788 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 32.9 mt -72.43 159.04 86.41 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.364 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -52.72 139.22 58.88 Favored 'Trans proline' 0 N--CA 1.493 1.484 0 C-N-CA 122.399 2.066 . . . . 0.0 112.121 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.22 -0.46 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.548 -179.971 . . . . . . . . 1 1 . 1 stop_ save_