data_1z8m_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1z8m _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.2 pp . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.839 0.352 . . . . 0.0 111.073 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.413 ' HD2' ' N ' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -82.36 153.99 25.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.916 -179.875 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.413 ' N ' ' HD2' ' A' ' 3' ' ' LYS . 3.1 tp -121.98 146.3 47.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.842 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -136.03 173.68 11.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.861 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.3 mp -144.56 138.02 27.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.981 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.3 mmtp -106.03 171.04 7.56 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.844 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 41.0 tttt -59.23 -30.08 67.99 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.99 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.1 t -70.42 -55.89 7.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.958 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.416 ' CE2' HD13 ' A' ' 78' ' ' LEU . 49.8 t80 -59.08 -33.8 71.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.973 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -60.56 -42.05 95.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.938 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.548 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 3.7 mtpt -89.97 -16.42 29.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.023 0.44 . . . . 0.0 111.464 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -90.75 -11.48 39.41 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.293 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.439 ' CE2' HG12 ' A' ' 31' ' ' ILE . 13.9 t80 -90.34 -69.88 0.7 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.806 0.336 . . . . 0.0 111.349 -179.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -90.76 -29.6 17.53 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -178.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.548 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.6 OUTLIER -79.0 -17.76 54.81 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.374 -179.284 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 38.2 tp -87.18 -34.5 19.0 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.552 HD12 ' CD1' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -51.78 -49.43 62.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.851 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 pp -84.28 2.48 39.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.708 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.75 32.02 2.74 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.938 0.399 . . . . 0.0 110.781 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.86 22.99 43.59 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.524 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.552 ' CD1' HD12 ' A' ' 18' ' ' LEU . 35.9 t80 -103.77 139.28 39.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.832 0.349 . . . . 0.0 110.709 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -70.48 97.79 1.35 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.823 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -68.56 -12.71 61.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.486 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.2 p -73.96 -24.78 59.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.684 -0.234 . . . . 0.0 111.358 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 11.4 p -86.06 -26.2 6.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.465 -179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.33 -37.24 86.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.833 0.349 . . . . 0.0 110.899 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -55.04 -22.19 14.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.315 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -85.94 -46.8 10.22 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.78 0.324 . . . . 0.0 111.362 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.416 HG12 ' CD1' ' A' ' 31' ' ' ILE . 9.5 p -75.04 -46.35 40.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.182 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.439 HG12 ' CE2' ' A' ' 14' ' ' PHE . 1.5 mp -66.19 -15.87 19.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.795 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.4 -27.87 38.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.257 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 58.0 m -87.34 -28.02 22.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.74 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 65.7 mt -90.2 -33.05 16.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.671 -179.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.8 mtp-105 -93.29 20.21 7.31 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.457 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -116.12 -55.94 2.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.583 0.23 . . . . 0.0 111.071 179.673 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.457 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.1 OUTLIER 158.27 -20.48 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.14 179.612 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.87 111.68 9.11 Favored Pre-proline 0 CA--C 1.53 0.182 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.067 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.69 156.8 53.07 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.428 2.085 . . . . 0.0 112.181 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 67.2 mt -65.66 141.8 58.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.96 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -90.15 155.92 46.67 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.04 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.02 -9.06 24.04 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.636 2.224 . . . . 0.0 112.576 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.66 3.68 31.89 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.473 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -94.41 17.99 12.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.611 0.243 . . . . 0.0 111.255 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 54.97 37.36 28.72 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.784 0.326 . . . . 0.0 110.998 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -77.35 121.44 23.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.057 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -172.95 -170.04 0.62 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.886 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.19 134.24 37.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.048 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mp -76.68 177.79 7.26 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.936 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.5 mtmm -113.89 152.65 30.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.891 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.36 -134.92 12.23 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.554 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.99 -13.0 60.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.654 0.264 . . . . 0.0 111.382 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 13.2 m95 -96.56 39.06 1.17 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.796 0.331 . . . . 0.0 110.875 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.444 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 6.9 tttm -69.25 -51.02 18.42 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.47 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.444 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 74.6 Cg_endo -78.36 47.88 2.54 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.305 2.003 . . . . 0.0 112.654 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.431 ' CE2' ' HG2' ' A' ' 55' ' ' PRO . 70.2 m-85 -154.24 170.96 20.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.808 0.337 . . . . 0.0 110.879 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.2 ttm105 -130.46 134.79 47.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.052 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -108.04 162.6 13.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.952 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 15.0 t -171.09 114.22 0.41 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.771 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.452 ' O ' ' CG ' ' A' ' 60' ' ' HIS . 16.9 p80 -90.18 85.11 6.17 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.077 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.422 ' CD1' ' HB3' ' A' ' 67' ' ' LEU . 3.8 mp -53.86 -26.85 14.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.968 179.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.524 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 18.3 mmmt -135.57 161.72 61.38 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.443 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.524 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 37.8 Cg_endo -66.16 -2.3 6.72 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.265 1.976 . . . . 0.0 112.89 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -137.99 23.7 2.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.794 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.3 t -135.71 149.15 27.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.141 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.1 mt -147.22 85.17 1.59 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.621 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.422 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 4.9 tp -86.59 127.87 34.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.124 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 52.0 t -102.4 138.08 28.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.011 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -151.88 170.74 19.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.954 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.8 tp -122.82 151.04 42.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.954 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 28.2 t -102.86 109.6 27.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.125 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.88 173.7 6.19 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.77 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -59.95 103.96 0.26 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.941 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 54.16 24.65 5.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.15 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -150.48 139.58 21.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.875 0.369 . . . . 0.0 110.955 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.2 tp -111.16 150.04 30.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.818 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.2 pp -135.88 130.34 48.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.44 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.416 HD13 ' CE2' ' A' ' 10' ' ' PHE . 80.6 mt -81.24 127.85 33.15 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.624 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.418 HD21 ' CD1' ' A' ' 56' ' ' PHE . 0.0 OUTLIER -88.34 -73.3 0.5 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.055 -179.77 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.92 174.27 15.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.987 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -127.35 139.36 52.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.856 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -151.55 -176.69 24.59 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.453 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 70.2 m -132.85 167.59 19.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.854 0.359 . . . . 0.0 110.753 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -56.76 -31.16 64.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.923 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.5 m -90.33 -22.7 21.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.325 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.58 -67.54 0.78 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.367 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 25.8 mt -51.33 -26.02 6.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.363 -179.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.885 179.989 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.1 mp . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.912 0.387 . . . . 0.0 110.85 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.43 160.24 7.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.889 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -125.21 155.86 39.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.043 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -149.61 -178.08 6.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.944 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 21.7 mt -140.23 141.02 35.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.847 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.4 mmtm -115.17 171.9 7.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.928 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.3 mtmm -70.19 -33.15 71.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.927 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.48 -34.38 78.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.827 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -66.51 -29.96 70.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.874 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -64.31 -48.61 74.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.6 mtpt -69.92 -24.46 63.38 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.042 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.498 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 7.1 m-20 -90.07 -22.98 21.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.02 0.438 . . . . 0.0 111.049 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.604 ' O ' HD22 ' A' ' 18' ' ' LEU . 73.4 t80 -90.9 -39.21 12.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.55 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -93.05 -58.06 2.44 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.105 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -47.21 68.58 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.498 ' HB2' ' HA ' ' A' ' 13' ' ' ASP . 3.0 tt -48.17 -39.48 21.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.235 0.54 . . . . 0.0 110.899 -179.136 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.604 HD22 ' O ' ' A' ' 14' ' ' PHE . 2.3 mm? -62.64 -32.43 73.48 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.904 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 21.0 mt -90.07 12.73 16.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.301 179.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -113.86 29.55 7.92 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.874 0.369 . . . . 0.0 110.86 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.23 22.88 46.58 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.796 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.466 ' CG ' ' CD2' ' A' ' 17' ' ' LEU . 83.4 t80 -113.34 122.93 48.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.923 0.392 . . . . 0.0 110.817 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.417 ' O ' ' CD2' ' A' ' 22' ' ' PHE . 3.4 t0 -58.37 159.66 5.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.867 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -108.69 -29.09 8.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.073 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.3 t -55.5 -23.57 26.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.169 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 20.6 t -79.46 -46.72 22.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.282 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.82 -28.57 66.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.94 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -68.23 -15.77 63.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.228 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -90.14 -37.1 14.43 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.344 -179.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.5 p -82.49 -34.26 11.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.819 0.342 . . . . 0.0 111.155 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.6 mp -76.47 -23.31 15.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.789 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.5 -24.77 59.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.076 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 89.4 m -90.1 -22.2 21.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.707 -179.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 12.5 mt -90.45 -42.42 10.88 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 -179.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 54.9 mtt180 -77.75 -40.27 41.56 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.467 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.2 OUTLIER -53.47 -55.78 22.39 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 121.197 -0.201 . . . . 0.0 111.485 -179.162 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.467 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 157.45 -20.41 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.087 179.736 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.37 123.03 27.45 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.159 -179.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.35 162.95 35.45 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.45 2.1 . . . . 0.0 112.264 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 83.6 mt -94.43 103.07 15.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.731 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -57.12 153.23 25.74 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.003 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -69.22 -10.35 28.75 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.504 2.136 . . . . 0.0 112.544 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.54 5.84 29.73 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.34 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -84.25 2.91 37.8 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.724 -0.216 . . . . 0.0 111.312 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 61.93 40.15 12.79 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.88 0.372 . . . . 0.0 111.033 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -78.71 87.21 4.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.767 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -120.53 176.06 5.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.038 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.1 175.26 0.54 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.11 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -113.7 -175.74 2.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.775 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.5 mmtm -135.29 157.61 46.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.879 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.06 -116.61 4.71 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.578 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.62 -24.79 26.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.784 0.326 . . . . 0.0 110.997 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 10.7 m95 -97.43 33.18 2.06 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.879 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.459 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 12.1 tttm -57.73 -50.19 89.49 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.405 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.459 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 72.3 Cg_endo -77.3 4.39 5.92 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.323 2.015 . . . . 0.0 113.009 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -106.75 174.84 5.71 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.753 0.311 . . . . 0.0 110.926 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.1 ttm180 -126.37 150.66 48.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.907 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -111.51 172.16 7.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.893 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -156.86 116.71 3.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.788 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -95.76 80.36 3.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.054 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.7 mp -67.23 -38.98 82.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.04 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.444 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 5.0 mttm -122.27 168.3 11.97 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.748 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.444 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 55.3 Cg_endo -69.67 -2.08 9.5 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.322 2.015 . . . . 0.0 112.824 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.9 p30 -144.35 26.88 1.44 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.773 179.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 90.6 t -133.28 141.13 45.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.102 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -157.19 94.06 1.37 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.632 179.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.72 136.55 41.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.918 -179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 38.8 t -84.63 140.79 15.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.011 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 32.0 p90 -143.87 158.76 43.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.889 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.5 tp -105.37 164.24 12.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.886 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.2 t -114.55 115.93 51.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.058 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -111.39 170.72 7.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.811 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.5 p-10 -64.47 103.81 0.71 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.817 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.3 t70 60.46 19.53 9.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.198 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -151.34 143.09 23.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.843 0.354 . . . . 0.0 110.848 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.2 tt -119.35 139.8 51.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.914 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.4 pp -122.9 135.54 62.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.177 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 64.0 mt -76.29 143.03 41.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.75 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.4 -70.88 0.75 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.11 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -154.57 173.04 16.86 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.95 0.405 . . . . 0.0 111.42 -179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -112.67 133.62 54.61 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.91 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -136.25 171.78 22.69 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.427 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 18.1 m -135.16 170.15 16.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.777 0.322 . . . . 0.0 110.898 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -58.99 -29.37 67.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.993 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.4 t -90.01 -28.29 19.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.987 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.28 -71.74 0.37 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.022 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.6 mt -69.33 -34.87 75.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.03 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.242 -0.885 . . . . 0.0 110.901 -179.955 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.9 mt . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.777 0.322 . . . . 0.0 110.918 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.86 151.36 4.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.044 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 7.6 tt -115.73 136.31 53.19 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.9 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -119.39 175.34 5.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.853 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 17.8 mt -141.98 114.05 8.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.011 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.8 mmpp? -95.64 -177.91 4.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.876 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.94 -31.2 56.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.847 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.4 -31.24 63.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.922 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -79.42 -30.91 42.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.98 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -59.5 -45.58 91.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.993 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.445 ' HA ' ' CB ' ' A' ' 16' ' ' LYS . 4.0 mttt -82.02 -18.96 41.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.261 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.453 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 6.3 m-20 -90.5 -17.39 27.17 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.083 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.431 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 88.7 t80 -91.35 -65.48 1.01 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.22 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -90.86 -45.62 8.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.138 -179.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.445 ' CB ' ' HA ' ' A' ' 12' ' ' LYS . 2.9 ttmt -70.55 -14.56 62.55 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.393 -179.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.453 ' HB2' ' HA ' ' A' ' 13' ' ' ASP . 26.6 tp -79.65 -39.12 32.16 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 14' ' ' PHE . 0.3 OUTLIER -68.27 -43.11 78.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.711 179.734 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.51 -34.21 77.73 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.695 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -65.23 -24.62 67.39 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.002 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 133.13 41.93 0.17 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.546 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -124.34 140.67 52.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.802 0.334 . . . . 0.0 110.885 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -63.68 114.34 3.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.944 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -72.08 -32.28 66.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.4 t -60.65 -49.84 75.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.383 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 60.1 t -51.46 -35.29 16.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.439 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.41 HD13 ' CE1' ' A' ' 14' ' ' PHE . 0.4 OUTLIER -66.42 -31.81 72.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.899 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -55.24 -47.24 75.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.931 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -57.39 -20.97 33.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.135 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 53.7 t -87.66 -69.4 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.011 0.434 . . . . 0.0 111.203 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.8 mp -48.9 -54.15 5.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.083 -179.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.27 -23.32 22.28 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.608 0.242 . . . . 0.0 111.281 -179.393 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 82.0 m -89.93 -26.22 20.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.757 0.313 . . . . 0.0 111.157 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 73.0 mt -90.1 -30.49 17.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.402 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 38.1 mtm180 -95.17 20.16 9.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.722 -179.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.469 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -113.79 -55.58 2.49 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 121.1 -0.24 . . . . 0.0 111.071 179.966 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.469 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 157.43 -20.6 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.114 179.605 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.96 110.9 3.96 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.01 -179.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.22 147.76 33.55 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.53 2.154 . . . . 0.0 112.248 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.7 mt -80.89 111.9 17.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.763 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -57.67 155.32 21.86 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.137 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -67.19 -11.58 32.74 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.616 2.211 . . . . 0.0 112.531 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.94 4.77 28.2 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.405 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -94.72 19.06 10.53 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.189 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 11.3 mp0 60.29 41.33 16.6 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.88 0.371 . . . . 0.0 110.984 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.1 p-10 -88.5 96.52 10.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.851 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 56.4 m80 -143.78 177.52 8.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.895 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.88 167.3 6.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.195 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.3 mt -114.49 -179.0 3.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.917 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.3 mtpp -131.27 153.98 48.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.843 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 100.16 -109.07 3.62 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.608 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.3 mmtt -101.58 -23.35 14.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.746 0.307 . . . . 0.0 111.111 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 4.9 m95 -96.07 29.13 2.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.032 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.539 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 1.0 OUTLIER -59.04 -54.65 54.38 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.31 -179.93 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.539 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 27.1 Cg_endo -62.73 -10.49 19.92 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.267 1.978 . . . . 0.0 112.507 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -99.52 168.26 10.08 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.802 0.334 . . . . 0.0 110.834 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 -120.51 150.05 41.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.922 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -104.14 172.96 6.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.009 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.0 t -171.1 105.1 0.23 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.76 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.414 ' CG ' HD23 ' A' ' 66' ' ' LEU . 6.7 m170 -78.53 91.83 4.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.041 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.1 mp -61.78 -41.33 90.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.957 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.433 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 0.2 OUTLIER -130.45 173.84 5.34 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.488 179.968 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.433 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 18.2 Cg_exo -66.15 -4.95 11.28 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.663 2.242 . . . . 0.0 112.796 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -145.13 29.71 1.17 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.866 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 77.3 t -143.41 138.21 26.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.237 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.414 HD23 ' CG ' ' A' ' 60' ' ' HIS . 0.0 OUTLIER -154.22 110.46 3.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.413 179.664 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -112.62 133.42 54.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.035 -179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 37.8 t -91.17 142.68 12.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.785 179.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -154.33 163.3 40.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.855 0.359 . . . . 0.0 111.111 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.0 tp -110.4 169.63 8.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.776 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 18.4 t -123.19 109.38 23.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.264 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.16 161.53 18.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.8 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -43.91 -61.61 1.39 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.445 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -123.85 28.3 6.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.905 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.7 mp0 -160.16 174.33 14.42 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.843 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.4 tt -136.42 149.06 48.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.736 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.3 pp -132.4 130.09 59.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.329 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 52.0 mt -76.46 137.39 39.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.612 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.17 -69.05 0.77 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.217 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.66 153.83 23.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.372 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -113.13 126.96 56.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.667 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -144.71 -171.48 14.57 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.557 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.3 t -127.73 171.44 11.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.77 0.319 . . . . 0.0 110.841 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -60.33 -29.88 69.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.961 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 37.6 m -81.37 -24.99 36.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.008 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.19 -72.04 0.46 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.998 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.6 mp -63.24 -38.96 93.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.912 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.196 -0.907 . . . . 0.0 110.892 -179.956 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.3 mt . . . . . 0 C--O 1.231 0.132 0 CA-C-O 120.799 0.333 . . . . 0.0 110.997 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.0 tmmm? -71.74 152.11 43.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.867 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 tt -122.01 143.52 49.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.931 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -128.62 -175.76 3.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.898 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.7 mp -144.43 128.51 17.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.973 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.87 -175.24 2.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.909 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.22 -38.1 43.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.908 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.2 m -68.17 -41.08 82.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.915 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.406 ' CZ ' HD13 ' A' ' 78' ' ' LEU . 20.7 t80 -58.86 -30.46 67.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.938 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -62.86 -46.47 87.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.954 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.527 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 1.2 mmmm -81.92 -20.47 38.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.004 0.43 . . . . 0.0 111.185 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -90.45 -10.94 41.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.082 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.434 ' O ' HD13 ' A' ' 18' ' ' LEU . 27.7 t80 -90.59 -69.0 0.75 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.875 0.369 . . . . 0.0 111.117 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -91.15 -32.71 15.72 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -179.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.527 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -76.08 -25.81 55.88 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 120.706 -0.398 . . . . 0.0 111.444 -178.99 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.411 ' O ' ' HB3' ' A' ' 22' ' ' PHE . 0.6 OUTLIER -75.64 -33.23 60.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.017 0.437 . . . . 0.0 110.037 179.182 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.521 HD11 ' CD1' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -55.63 -42.55 75.13 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.85 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.5 pp -83.99 -0.86 53.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.479 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.01 36.24 1.59 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.883 0.373 . . . . 0.0 110.94 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.18 25.8 46.83 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.397 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.521 ' CD1' HD11 ' A' ' 18' ' ' LEU . 11.5 t80 -114.08 130.47 56.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.722 0.296 . . . . 0.0 110.806 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.402 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 4.8 t70 -72.71 116.11 12.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.951 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 20.1 p-10 -68.33 -25.07 64.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.14 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.7 m -64.71 -21.15 66.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.296 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.8 t -83.93 -40.42 15.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.474 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 pp -57.78 -36.1 71.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.804 0.335 . . . . 0.0 111.129 -179.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -57.36 -20.6 30.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.418 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -84.55 -37.49 21.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.693 0.282 . . . . 0.0 111.34 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.0 p -90.41 -36.62 8.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.849 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.4 mp -71.13 -50.03 44.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.588 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.424 HD13 ' OG1' ' A' ' 33' ' ' THR . 0.0 OUTLIER -57.91 -18.92 26.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.549 0.214 . . . . 0.0 111.462 -179.454 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.424 ' OG1' HD13 ' A' ' 32' ' ' LEU . 85.1 m -84.75 -30.85 24.35 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.9 0.381 . . . . 0.0 110.703 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 66.0 mt -89.55 -30.73 18.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.444 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 13.4 mtt-85 -93.55 20.18 7.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.774 -179.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.443 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 24.4 mttm -119.47 -55.45 2.12 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.576 0.227 . . . . 0.0 111.024 179.791 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.443 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 159.62 -20.65 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.199 179.751 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -65.89 111.24 5.92 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.028 -179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.95 -179.97 3.87 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.48 2.12 . . . . 0.0 112.2 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 44.1 mt -102.44 117.45 34.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.9 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -61.45 157.04 48.77 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.042 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -69.03 -10.28 28.71 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.582 2.188 . . . . 0.0 112.548 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.87 11.19 18.66 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.31 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.432 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.4 m-85 -88.48 5.25 43.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.26 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 63.48 36.73 11.06 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.852 0.358 . . . . 0.0 110.897 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -80.65 110.37 16.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.902 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -148.56 174.76 11.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.846 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -92.44 128.26 38.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.088 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 24.7 mt -78.66 -167.9 1.23 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.847 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.2 mmtm -130.26 164.53 24.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.85 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 79.44 -122.78 5.89 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.456 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.32 -30.23 64.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.842 0.353 . . . . 0.0 110.831 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 33.1 m95 -98.45 27.35 4.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.928 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.495 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -75.94 -50.45 3.14 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.775 -179.678 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.495 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 53.0 Cg_endo -70.75 -3.26 12.31 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.165 1.91 . . . . 0.0 112.905 -179.564 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.42 ' CD1' ' HG ' ' A' ' 79' ' ' LEU . 39.3 m-85 -114.35 167.39 10.75 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.834 0.35 . . . . 0.0 110.749 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 11.1 ttm180 -117.03 141.54 48.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.046 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -98.09 171.72 8.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.017 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.8 t -169.94 122.09 0.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.776 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 23.3 m170 -101.72 87.31 3.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.082 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.432 ' HA ' ' CD2' ' A' ' 44' ' ' PHE . 3.5 mp -64.38 -51.2 71.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.871 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.519 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 16.7 mmmt -118.32 167.7 10.96 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.205 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.519 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 55.9 Cg_endo -70.86 1.75 4.84 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.081 1.854 . . . . 0.0 112.899 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -142.17 25.02 1.94 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.778 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.1 t -140.17 149.75 21.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.177 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.8 mt -146.41 101.84 3.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.878 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -95.09 131.97 40.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.953 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 81.8 t -107.24 110.95 33.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.362 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.41 ' CE1' HD11 ' A' ' 76' ' ' LEU . 26.9 p90 -124.81 162.65 23.85 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.101 -179.36 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.5 tp -118.46 133.36 55.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.867 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 7.2 p -74.47 158.52 5.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.046 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 1.3 tptt -159.35 171.57 19.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.834 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -59.53 100.09 0.07 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.986 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 52.83 23.94 3.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.238 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -148.88 147.05 28.23 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.833 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.41 HD11 ' CE1' ' A' ' 69' ' ' TYR . 0.5 OUTLIER -121.05 151.59 39.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.92 179.915 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.2 pp -133.42 130.91 57.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.269 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.406 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 67.7 mt -80.26 124.75 29.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.785 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.42 ' HG ' ' CD1' ' A' ' 56' ' ' PHE . 0.1 OUTLIER -87.24 -62.79 1.42 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.914 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.78 162.74 16.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.933 0.397 . . . . 0.0 111.214 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -104.56 143.11 33.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.817 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -147.1 177.5 25.35 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.451 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.3 m -143.05 171.66 13.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.854 0.359 . . . . 0.0 110.984 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -60.55 -29.23 69.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.93 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.4 t -88.89 -25.23 22.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.042 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.7 -68.2 0.72 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.962 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 22.8 mt -70.14 -39.14 75.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.051 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.312 -0.851 . . . . 0.0 110.873 -179.996 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.823 0.344 . . . . 0.0 111.022 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.66 151.75 19.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.818 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.1 tt -116.01 143.73 45.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.979 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -123.6 -177.52 3.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.863 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -142.1 118.31 10.75 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.837 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -95.47 174.08 7.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.859 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 44.5 mttt -74.21 -41.84 60.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.825 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.1 p -66.66 -31.32 71.92 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.812 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -75.0 -33.86 61.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.833 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -65.0 -38.64 91.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.806 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.552 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 8.9 pttt -81.65 -25.83 35.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.094 0.473 . . . . 0.0 110.994 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.465 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 6.7 m-20 -90.66 -13.45 34.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.068 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.438 ' O ' ' CD2' ' A' ' 18' ' ' LEU . 20.5 t80 -91.7 -62.04 1.51 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.105 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.09 -43.67 9.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.287 -179.213 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.552 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 28.5 mttm -73.31 -17.08 61.35 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 120.908 -0.317 . . . . 0.0 111.477 -178.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.465 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 21.5 tp -76.79 -37.82 55.11 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.487 -0.561 . . . . 0.0 109.487 179.188 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.438 ' CD2' ' O ' ' A' ' 14' ' ' PHE . 0.4 OUTLIER -67.16 -33.08 74.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.853 179.85 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.0 mt -74.9 -35.55 62.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.84 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.39 -22.69 67.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.099 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 133.09 41.03 0.19 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.463 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -124.04 144.31 49.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.868 0.366 . . . . 0.0 110.861 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -69.24 122.55 19.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.017 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.407 ' CB ' HD11 ' A' ' 18' ' ' LEU . 28.4 p-10 -78.94 -27.63 43.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.201 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.8 -56.15 13.46 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.399 -179.476 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 14.5 p -49.37 -28.48 3.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.629 -179.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.416 HD12 ' CE2' ' A' ' 14' ' ' PHE . 0.3 OUTLIER -72.88 -33.26 65.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.9 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -55.28 -50.72 68.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.002 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -59.17 -23.92 62.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.094 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 91.1 t -77.72 -72.2 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.105 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.427 HG21 ' HG3' ' A' ' 35' ' ' ARG . 1.5 mp -49.37 -27.48 2.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.229 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.68 -36.4 80.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.858 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 61.9 m -70.59 -27.62 64.24 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.497 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 21.3 mt -90.26 -29.51 18.11 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.669 -179.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.427 ' HG3' HG21 ' A' ' 31' ' ' ILE . 10.8 mtp180 -97.09 20.21 11.67 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -179.275 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.495 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.5 OUTLIER -121.38 -55.83 1.92 Allowed 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 121.022 -0.271 . . . . 0.0 111.086 179.746 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.495 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 6.1 pttm 152.04 -20.44 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.036 0.534 . . . . 0.0 110.949 179.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.56 114.79 14.34 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.993 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.53 -179.67 4.32 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.416 2.078 . . . . 0.0 112.146 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.5 mp -108.33 142.71 38.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.962 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.06 157.88 74.23 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.107 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.66 -10.02 25.92 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.612 2.208 . . . . 0.0 112.663 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.19 20.6 8.96 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.142 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.402 ' CG ' ' O ' ' A' ' 60' ' ' HIS . 8.4 m-30 -104.14 8.48 36.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.218 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 59.42 37.26 23.21 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.875 0.369 . . . . 0.0 110.878 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.3 p-10 -79.26 104.26 9.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.874 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -169.18 176.94 5.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.876 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.31 148.16 48.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.001 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mt -96.85 178.78 5.18 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.825 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 11.6 ptpt -112.88 179.27 4.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.986 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 67.1 -145.17 45.94 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.601 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 9.4 mmtm -59.94 -20.45 57.52 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.638 0.256 . . . . 0.0 111.105 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 8.7 m95 -96.81 39.28 1.18 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.992 0.425 . . . . 0.0 110.827 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.44 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.8 OUTLIER -70.19 -49.14 18.66 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.426 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.44 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 86.2 Cg_endo -83.1 37.64 0.68 Allowed 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.572 2.181 . . . . 0.0 113.031 -179.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.43 ' CD1' ' O ' ' A' ' 55' ' ' PRO . 20.9 m-85 -136.4 172.65 12.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.698 179.651 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 27.0 ttm105 -136.14 135.17 39.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.844 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -96.0 167.63 11.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.892 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -166.56 111.93 0.8 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.807 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.405 ' N ' ' CD2' ' A' ' 60' ' ' HIS . 12.1 m170 -91.29 85.15 5.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.003 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.8 mp -58.51 -29.66 39.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.013 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.418 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 29.2 mttt -139.71 162.81 48.9 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.604 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.418 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 31.3 Cg_endo -63.71 -8.12 14.64 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.312 2.008 . . . . 0.0 112.77 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -133.3 26.52 4.15 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.591 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 60.6 t -142.72 145.44 23.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.168 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -148.46 97.76 2.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.646 179.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -91.79 135.4 33.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.01 0.434 . . . . 0.0 111.1 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 97.7 t -108.1 124.89 64.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.889 178.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.454 ' CD1' ' CD1' ' A' ' 76' ' ' LEU . 13.6 p90 -137.27 153.78 50.26 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.224 -179.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -112.55 131.9 55.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.946 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 8.1 p -78.79 159.67 4.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.062 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? -143.66 160.61 40.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.864 179.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -40.27 -32.96 0.21 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.773 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.7 p-10 -164.93 30.97 0.06 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.922 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 71.7 mt-10 -153.35 158.34 41.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.868 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.454 ' CD1' ' CD1' ' A' ' 69' ' ' TYR . 6.0 tp -123.14 137.47 54.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.416 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.0 pp -127.42 134.67 65.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.424 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 28.2 mt -86.99 124.75 33.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.858 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.43 -64.74 1.11 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.824 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -162.33 171.21 17.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.085 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -126.26 132.05 51.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.946 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -143.59 165.46 27.16 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.467 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 17.3 m -104.79 173.95 6.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.724 0.297 . . . . 0.0 110.983 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -64.36 -24.52 67.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.06 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 73.4 m -89.98 -26.83 20.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.08 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -73.91 -68.18 0.54 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.041 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 17.3 mt -72.15 -32.11 66.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.018 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.899 179.918 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 mp . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.907 0.384 . . . . 0.0 111.007 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.55 172.07 8.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.77 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.9 tt -137.27 153.98 50.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.899 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -146.48 176.31 9.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.917 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.3 mt -137.74 131.24 31.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.867 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -103.28 166.06 10.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.915 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.63 -30.88 69.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.886 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.1 m -76.55 -41.73 45.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.863 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.42 ' CZ ' HD12 ' A' ' 78' ' ' LEU . 22.5 t80 -71.45 -34.88 70.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.87 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -59.85 -40.71 89.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.802 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.514 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -89.98 -15.31 32.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.276 -179.959 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.434 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 5.0 m-20 -90.36 -11.12 41.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.185 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.427 ' O ' ' CD1' ' A' ' 18' ' ' LEU . 17.2 t80 -90.74 -67.08 0.87 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.978 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -90.95 -34.37 15.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.163 -179.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.514 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -76.44 -19.42 58.08 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.508 -179.127 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.434 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 36.5 tp -82.47 -34.25 28.15 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.546 HD12 ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -50.98 -48.69 61.14 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.905 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 27.7 mt -90.16 12.86 16.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.467 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -111.09 31.65 5.89 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.878 0.371 . . . . 0.0 110.86 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.01 22.83 22.0 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.473 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.546 ' CD1' HD12 ' A' ' 18' ' ' LEU . 29.4 t80 -117.08 143.91 45.25 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.81 0.338 . . . . 0.0 110.851 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.416 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 3.9 t70 -91.92 111.05 22.43 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.856 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 36.2 p-10 -53.89 -27.31 29.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.202 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.8 t -60.73 -19.39 58.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.246 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.8 t -88.55 -40.7 13.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.691 0.281 . . . . 0.0 111.486 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 pp -57.65 -36.48 71.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.118 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -62.78 -28.01 69.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.009 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -75.06 -34.2 61.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.186 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.44 HG11 ' CD1' ' A' ' 31' ' ' ILE . 10.9 p -89.96 -47.29 14.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.395 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.44 ' CD1' HG11 ' A' ' 30' ' ' VAL . 1.6 mp -58.05 -25.14 25.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.86 0.362 . . . . 0.0 110.707 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.413 ' CD2' ' N ' ' A' ' 33' ' ' THR . 0.2 OUTLIER -70.52 -52.5 21.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.27 -179.721 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.413 ' N ' ' CD2' ' A' ' 32' ' ' LEU . 89.3 m -66.56 -23.97 66.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.918 -179.349 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 76.2 mt -89.95 -33.61 16.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.756 0.312 . . . . 0.0 111.591 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.1 mtt180 -98.81 20.22 13.48 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -179.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.514 ' O ' ' HB3' ' A' ' 37' ' ' LYS . 4.0 mtmt -108.69 -55.88 2.34 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.033 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.514 ' HB3' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 150.83 -20.38 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.122 0.569 . . . . 0.0 110.801 179.622 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.62 126.36 89.48 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.605 -0.27 . . . . 0.0 110.987 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -75.08 169.41 22.65 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.449 2.099 . . . . 0.0 112.278 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.6 mt -95.82 126.09 40.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.802 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -72.26 162.16 75.21 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.055 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -68.89 -27.54 30.65 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.609 2.206 . . . . 0.0 112.304 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -64.76 -15.54 61.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.326 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -79.17 -0.19 30.85 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.57 -0.287 . . . . 0.0 111.552 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 67.83 48.56 1.01 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.959 0.409 . . . . 0.0 110.843 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.2 p-10 -88.92 89.02 7.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.772 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -151.48 -179.88 7.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.044 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -84.46 125.08 32.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.112 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 90.0 mt -72.3 -178.57 2.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.898 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -110.15 172.75 6.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.928 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 78.21 -117.96 4.8 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.587 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.2 mttm -89.63 -18.03 27.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.578 0.228 . . . . 0.0 111.298 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 16.5 m-90 -96.18 38.26 1.2 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.805 0.336 . . . . 0.0 111.083 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.435 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 5.0 mtpt -83.96 -50.92 0.62 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.042 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 17.0 Cg_exo -66.62 -8.84 22.29 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.505 2.137 . . . . 0.0 112.475 179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -105.75 -171.64 1.94 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.904 0.383 . . . . 0.0 111.066 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.1 ttm-85 -138.92 136.22 35.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.847 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -106.19 162.79 13.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.114 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.401 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 3.1 t -162.71 117.45 1.78 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.906 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -90.28 89.47 7.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.932 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.0 mp -60.53 -31.4 48.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.069 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.5 mttm -141.42 172.86 5.45 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.765 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -66.78 -6.35 15.42 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.706 2.27 . . . . 0.0 112.663 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -142.27 26.09 1.84 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.879 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 64.5 t -141.06 140.85 32.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.184 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -159.14 110.3 2.06 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.759 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.3 131.8 54.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.712 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 41.5 t -88.68 140.45 15.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.98 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.401 ' CE2' ' HB2' ' A' ' 59' ' ' CYS . 2.6 p90 -146.77 159.36 43.6 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.918 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 2.8 tp -109.24 171.98 7.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.856 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 28.7 t -123.26 103.71 13.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.181 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.06 168.37 10.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.743 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -58.76 104.04 0.2 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.832 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 57.0 22.05 6.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.122 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -148.68 138.21 21.95 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.748 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.7 tp -108.03 143.93 36.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.933 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.2 pp -131.64 130.26 62.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.201 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.42 HD12 ' CZ ' ' A' ' 10' ' ' PHE . 74.9 mt -76.28 135.4 39.62 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.747 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.36 -62.68 1.29 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.137 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.69 164.59 18.99 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.931 0.396 . . . . 0.0 111.472 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -125.19 126.73 45.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.598 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -146.31 -174.9 18.86 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.557 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 22.7 m -110.55 174.46 5.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.91 0.386 . . . . 0.0 111.031 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.33 -25.3 65.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.981 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 69.6 m -86.93 -15.97 37.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.281 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -86.79 -69.28 0.69 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.02 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.5 mp -63.15 -41.23 99.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.079 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.208 -0.901 . . . . 0.0 110.958 179.961 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.775 0.322 . . . . 0.0 110.917 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.9 151.32 47.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.892 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.2 tt -121.21 154.38 36.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.83 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -147.54 155.81 42.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.901 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.9 mp -124.78 126.78 46.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.976 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -100.52 158.97 15.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.957 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.3 tttm -61.26 -31.74 71.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.899 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 6.6 m -66.1 -28.96 69.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.032 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -73.87 -32.4 63.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.134 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -79.29 -30.08 42.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.056 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.03 -16.2 30.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.387 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -81.74 -30.48 32.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.639 0.257 . . . . 0.0 111.148 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.455 ' CE2' ' CD1' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -90.42 -53.02 4.62 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 179.538 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -51.48 -34.47 35.84 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.06 0.457 . . . . 0.0 110.074 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.54 -27.98 37.42 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.097 179.044 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.2 mt -76.12 -41.5 49.92 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.1 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.493 HD13 ' CD1' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -54.13 -33.18 57.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.992 179.914 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 mt -90.06 -5.86 56.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.617 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.64 38.01 1.24 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.846 0.355 . . . . 0.0 111.068 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.67 26.71 41.27 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.502 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.493 ' CD1' HD13 ' A' ' 18' ' ' LEU . 10.6 t80 -119.51 128.39 53.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.814 0.34 . . . . 0.0 110.88 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.41 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 8.0 t70 -84.85 131.28 34.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.996 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.7 p-10 -56.9 -21.8 32.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.099 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.6 t -48.15 -53.45 16.69 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.821 0.343 . . . . 0.0 110.955 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.41 ' HB ' ' CZ ' ' A' ' 22' ' ' PHE . 39.2 t -65.14 -35.11 74.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.669 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.455 ' CD1' ' CE2' ' A' ' 14' ' ' PHE . 1.1 tp -59.14 -33.52 70.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.669 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -59.35 -47.09 86.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.912 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -63.14 -40.06 96.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.932 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 94.6 t -66.27 -72.46 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.09 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.2 mp -45.76 -33.45 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 121.152 0.501 . . . . 0.0 110.523 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.497 ' HG ' ' HG2' ' A' ' 36' ' ' LYS . 0.3 OUTLIER -55.51 -59.97 4.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.17 179.35 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.42 ' N ' ' CD2' ' A' ' 32' ' ' LEU . 64.6 m -54.34 -24.45 19.39 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.307 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 17.7 mt -73.36 -62.08 1.6 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.844 0.354 . . . . 0.0 110.961 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.4 mtp180 -67.9 -49.0 64.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.029 0.442 . . . . 0.0 110.921 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.547 ' O ' ' CG ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -68.55 -13.77 62.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.533 179.882 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.547 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 1.3 pttm 52.59 70.73 0.54 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.679 -179.549 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.407 ' CB ' ' HD2' ' A' ' 36' ' ' LYS . 1.3 tm-20 -81.56 142.48 49.84 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.636 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -61.32 104.8 0.31 Allowed 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.366 2.044 . . . . 0.0 112.135 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 57.3 mt -68.3 137.61 54.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.99 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -87.29 158.42 52.19 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.82 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.32 -26.72 63.65 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.504 2.136 . . . . 0.0 112.224 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -67.68 -21.46 65.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.094 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.429 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.2 m-85 -56.5 -27.64 57.75 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.003 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 63.29 61.33 1.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.939 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.0 p-10 -91.45 77.35 5.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.871 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -125.89 -175.29 3.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.043 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.07 166.97 21.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.253 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -104.44 -167.55 1.37 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.885 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -126.1 151.38 47.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.864 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 92.12 -136.03 13.03 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.564 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.22 -11.81 61.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.614 0.245 . . . . 0.0 111.352 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 17.3 m-90 -96.69 39.33 1.17 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.969 0.414 . . . . 0.0 111.007 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.484 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 2.4 ttmm -72.71 -50.25 7.62 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.468 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.484 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 63.1 Cg_endo -74.43 0.43 8.61 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.336 2.024 . . . . 0.0 112.932 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -102.83 179.78 4.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.808 0.337 . . . . 0.0 110.817 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.421 ' HG2' ' CE1' ' A' ' 69' ' ' TYR . 12.1 ttm180 -147.14 134.39 20.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.833 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -95.85 162.93 13.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.002 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.422 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 21.6 t -163.87 105.91 0.93 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.847 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.434 ' CD2' ' N ' ' A' ' 60' ' ' HIS . 6.8 m170 -84.79 94.96 8.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.955 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.43 ' CD1' ' HB3' ' A' ' 67' ' ' LEU . 4.4 mp -66.09 -25.22 35.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.913 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.43 169.96 10.67 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.766 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -70.86 1.2 5.4 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.798 2.332 . . . . 0.0 112.866 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -144.38 24.06 1.6 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.845 0.355 . . . . 0.0 110.778 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.4 t -136.49 153.13 30.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.919 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.422 HD21 ' CD2' ' A' ' 60' ' ' HIS . 3.7 mt -145.56 112.27 5.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.775 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.43 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 4.7 tp -106.66 128.74 54.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.018 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 66.9 t -108.4 134.16 51.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.753 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.422 ' CE2' ' HB2' ' A' ' 59' ' ' CYS . 2.8 p90 -144.07 165.43 27.81 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.886 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.3 tp -100.24 157.53 16.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.871 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.4 t -113.31 103.82 16.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.116 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.9 tttp -83.17 161.74 21.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.719 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -44.02 -35.87 2.27 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.443 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.0 p-10 -156.0 29.66 0.36 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.82 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -152.5 156.6 39.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.814 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 11.8 tp -119.67 139.92 51.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.715 179.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.8 pp -133.35 127.95 54.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.212 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 58.9 mt -70.22 139.81 52.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.95 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.32 -73.72 0.65 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.058 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.08 174.61 13.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.875 0.369 . . . . 0.0 111.364 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -120.93 140.65 51.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.838 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -147.13 -176.85 21.2 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.572 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.1 t -139.81 -172.03 3.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.818 0.342 . . . . 0.0 110.912 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.8 t-160 -72.63 -28.66 62.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.965 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.01 -23.06 21.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.088 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -85.74 -71.12 0.55 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.874 0.368 . . . . 0.0 111.003 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 72.6 mt -60.45 -40.66 91.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.992 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.175 -0.917 . . . . 0.0 110.976 179.946 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.3 mt . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.897 0.38 . . . . 0.0 110.857 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.42 142.37 55.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.781 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 7.7 tp -114.03 154.45 27.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.013 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -138.9 176.04 9.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.832 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.0 mt -138.9 129.06 25.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.997 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 25.8 mmtm -97.21 -177.45 3.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.784 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.83 -33.85 39.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.924 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.6 m -74.59 -34.34 62.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.016 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -61.16 -29.22 69.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.075 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -71.55 -42.39 67.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.02 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.509 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 2.6 mtmm -78.54 -19.51 52.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.284 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -90.4 -10.39 44.05 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.095 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.451 ' O ' ' CD2' ' A' ' 18' ' ' LEU . 6.7 t80 -91.17 -66.03 0.96 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.801 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -91.46 -37.73 12.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.89 -0.595 . . . . 0.0 112.15 -179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.509 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -75.49 -18.27 59.89 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 120.941 -0.304 . . . . 0.0 111.677 -178.799 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.2 tt -79.81 -34.1 39.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.977 0.418 . . . . 0.0 109.891 179.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.451 ' CD2' ' O ' ' A' ' 14' ' ' PHE . 0.8 OUTLIER -66.65 -33.82 76.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.799 179.641 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.9 mt -80.57 -36.05 33.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.911 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -57.61 -22.73 47.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.086 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.98 36.7 0.27 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.687 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.406 ' CE2' ' O ' ' A' ' 23' ' ' ASP . 75.0 t80 -122.11 163.3 19.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.72 0.295 . . . . 0.0 110.951 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.406 ' O ' ' CE2' ' A' ' 22' ' ' PHE . 9.9 t70 -86.31 123.08 31.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.941 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -77.85 -31.61 51.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.985 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.0 t -60.86 -40.79 94.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.35 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 45.3 t -58.66 -37.99 68.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.341 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.83 -33.58 73.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.975 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -58.36 -29.0 65.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.122 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -72.04 -44.39 63.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.031 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.409 HG11 ' CD1' ' A' ' 31' ' ' ILE . 10.8 p -80.13 -46.15 22.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.148 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.426 HG12 ' CE2' ' A' ' 14' ' ' PHE . 1.6 mp -58.42 -29.96 39.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.921 0.391 . . . . 0.0 110.657 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.1 -24.7 65.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.166 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 51.4 m -90.21 -24.0 21.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.568 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.0 mt -90.11 -38.8 13.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.593 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 51.9 mtp85 -90.56 20.15 4.81 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.479 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 2.2 mttm -110.98 -55.76 2.45 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 121.106 -0.238 . . . . 0.0 111.012 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.479 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 155.65 -20.5 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.109 179.669 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -78.24 113.05 30.31 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.152 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -74.58 -179.55 4.95 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.545 2.163 . . . . 0.0 112.108 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.425 HD13 ' CE2' ' A' ' 69' ' ' TYR . 15.6 mt -87.78 116.1 25.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.822 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -60.9 159.38 27.21 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.999 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.46 -9.34 25.03 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.602 2.201 . . . . 0.0 112.574 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.14 8.95 24.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.293 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -92.39 11.7 25.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.658 0.266 . . . . 0.0 111.294 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 60.93 32.05 19.98 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.803 0.335 . . . . 0.0 110.984 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -69.26 98.61 1.06 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.81 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 32.5 m80 -144.27 177.17 8.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.888 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.53 129.82 34.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.135 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 21.8 mt -72.63 -178.93 2.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.868 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.3 mtmt -120.36 169.72 10.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.924 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 79.12 -118.25 4.74 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.492 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.53 -21.75 30.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.663 0.268 . . . . 0.0 111.221 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 6.2 m95 -96.27 38.71 1.18 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.848 0.356 . . . . 0.0 110.885 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.423 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 11.6 ttmt -73.77 -51.29 5.26 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.237 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.423 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 89.2 Cg_endo -79.77 47.1 2.41 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.307 2.005 . . . . 0.0 112.481 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -157.65 175.92 13.29 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.868 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 -130.96 134.39 46.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.853 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -104.83 167.64 9.59 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.982 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.3 t -171.1 115.4 0.42 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.659 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.418 ' O ' ' CG ' ' A' ' 60' ' ' HIS . 12.2 p80 -93.33 109.55 21.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.058 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.3 mp -77.92 -27.68 15.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.754 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.424 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 12.6 mtpp -133.18 168.94 15.4 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.6 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.424 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 14.8 Cg_exo -68.72 -0.3 5.89 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.634 2.222 . . . . 0.0 113.015 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -144.47 27.61 1.37 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.811 0.338 . . . . 0.0 110.801 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.3 t -136.38 148.72 27.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.037 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.0 mt -147.06 93.24 2.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.78 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.2 tp -93.81 120.45 34.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.85 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 47.7 t -94.32 135.35 28.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.04 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.44 ' CD1' ' CD1' ' A' ' 76' ' ' LEU . 29.6 p90 -147.36 168.2 22.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.101 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.6 tp -122.18 143.36 49.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.694 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -102.07 99.15 7.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.246 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.416 ' O ' ' C ' ' A' ' 73' ' ' ASP . 0.0 OUTLIER -77.44 167.09 22.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.72 179.883 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.416 ' C ' ' O ' ' A' ' 72' ' ' LYS . 1.2 p30 -30.04 -60.75 0.17 Allowed 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.196 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -143.67 30.82 1.33 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.789 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -154.51 109.44 3.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.194 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.44 ' CD1' ' CD1' ' A' ' 69' ' ' TYR . 1.6 tp -70.32 141.82 52.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.79 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.1 pp -129.8 136.54 58.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.321 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 82.0 mt -79.41 137.88 37.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.835 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.92 -72.8 0.63 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.959 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.16 174.01 15.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.191 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -120.04 131.76 55.23 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.746 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -145.4 -174.82 17.97 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.545 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 20.0 m -152.55 -173.31 4.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.905 0.383 . . . . 0.0 110.805 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 -65.72 -30.57 71.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.854 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 55.9 m -89.91 -30.27 17.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.94 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -74.77 -73.39 0.24 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.943 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 33.9 mt -65.64 -34.19 77.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.842 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.946 179.983 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 20.0 mt . . . . . 0 N--CA 1.457 -0.104 0 CA-C-O 120.829 0.347 . . . . 0.0 110.935 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.45 151.48 20.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.815 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.1 tp -116.49 148.75 40.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.852 0.358 . . . . 0.0 111.051 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -140.67 -179.13 5.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.823 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.1 mp -144.62 143.69 30.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.929 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.6 mmtt -114.88 -177.92 3.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.906 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.46 -31.46 67.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.812 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.84 -33.59 68.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.928 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -80.06 -32.13 39.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.938 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -59.94 -38.56 82.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.906 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.527 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 2.7 pttp -86.27 -22.68 26.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.165 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -90.7 -10.43 43.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.241 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.456 ' O ' ' CD1' ' A' ' 18' ' ' LEU . 93.9 t80 -90.58 -67.46 0.85 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.16 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -91.0 -31.46 16.31 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -179.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.527 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -77.91 -26.52 49.1 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.482 -179.07 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.54 -31.34 60.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.92 0.39 . . . . 0.0 110.17 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.505 HD12 ' CD1' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -55.68 -43.3 76.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.045 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.0 pp -90.11 15.02 10.95 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.494 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -113.64 33.1 5.36 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.795 0.331 . . . . 0.0 110.813 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.55 27.08 23.38 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.304 -179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.505 ' CD1' HD12 ' A' ' 18' ' ' LEU . 14.3 t80 -115.2 149.7 37.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.83 0.348 . . . . 0.0 110.824 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.455 ' N ' ' CD1' ' A' ' 22' ' ' PHE . 46.2 t0 -92.52 98.75 11.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.91 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -54.06 -30.21 47.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.244 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.4 m -58.88 -26.22 64.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.161 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 38.3 t -84.6 -36.47 11.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.299 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.422 HD12 ' CE1' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -55.53 -35.8 66.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.85 -179.925 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.432 ' O ' ' HB3' ' A' ' 32' ' ' LEU . 8.7 t-20 -53.41 -66.09 0.45 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.172 -179.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -46.9 -28.57 1.64 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.484 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 37.9 t -75.37 -69.59 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.306 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.1 mp -55.97 -24.38 17.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.082 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.432 ' HB3' ' O ' ' A' ' 28' ' ' ASN . 0.1 OUTLIER -71.23 -21.17 62.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.97 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.6 m -90.0 -33.55 16.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.881 0.372 . . . . 0.0 111.464 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.1 mt -90.17 -26.33 20.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.786 -179.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 26.6 mtt180 -99.01 20.29 13.57 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -179.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.459 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 2.7 mtmt -116.47 -55.63 2.36 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.92 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.459 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 157.45 -20.55 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.161 179.665 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -63.84 110.64 4.01 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.069 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.43 166.89 25.65 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.399 2.066 . . . . 0.0 112.235 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.5 mt -94.71 123.25 38.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.977 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -68.2 156.86 89.06 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.934 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.33 -8.8 24.48 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.678 2.252 . . . . 0.0 112.512 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -89.48 12.01 17.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.395 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -98.89 14.23 29.74 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.711 0.291 . . . . 0.0 111.249 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 56.02 36.08 26.72 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.856 0.36 . . . . 0.0 111.064 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -82.56 90.45 6.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.902 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -138.62 -178.38 5.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.873 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.36 142.03 32.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.213 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 15.3 mt -83.62 -172.25 4.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.798 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.8 mmtt -116.57 163.12 16.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.975 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.82 -136.07 18.2 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.52 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.5 mmpt? -67.22 -18.24 65.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.566 0.222 . . . . 0.0 111.225 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -96.45 31.93 2.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.741 0.305 . . . . 0.0 111.154 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 3.0 mttt -79.63 -51.38 1.19 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.911 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 23.7 Cg_exo -63.76 -11.81 28.46 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.514 2.143 . . . . 0.0 112.234 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.418 ' CE1' HD13 ' A' ' 79' ' ' LEU . 73.1 m-85 -105.17 171.87 7.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.813 0.339 . . . . 0.0 110.973 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.0 ttp85 -125.73 154.35 42.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.837 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -117.79 162.22 18.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.054 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 38.0 t -150.65 145.33 25.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.803 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.418 ' CE1' HD23 ' A' ' 66' ' ' LEU . 9.9 m170 -116.49 87.19 2.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.944 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 5.3 mp -60.01 -28.28 40.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.936 0.398 . . . . 0.0 110.645 179.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.448 ' HB2' ' CD ' ' A' ' 63' ' ' PRO . 1.3 ptmm? -160.38 169.65 9.82 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.331 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.448 ' CD ' ' HB2' ' A' ' 62' ' ' LYS . 16.7 Cg_exo -67.93 5.8 0.99 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.697 2.264 . . . . 0.0 113.662 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -139.86 26.14 2.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.55 0.214 . . . . 0.0 111.326 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 47.2 t -155.6 149.32 11.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.931 0.396 . . . . 0.0 111.506 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.418 HD23 ' CE1' ' A' ' 60' ' ' HIS . 4.2 mt -146.82 117.33 7.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.663 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -107.22 131.79 53.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.906 0.384 . . . . 0.0 111.189 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 71.3 t -105.62 118.6 53.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.811 178.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.415 ' CD2' HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -133.64 -179.24 5.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.473 -179.296 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.2 tp -125.72 169.36 12.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.826 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.6 t -121.02 100.48 9.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.255 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.85 163.63 27.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.549 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -43.18 -36.91 1.89 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.416 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -154.13 25.68 0.48 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.836 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 75.1 mt-10 -149.41 173.39 13.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.876 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.415 HD21 ' CD2' ' A' ' 69' ' ' TYR . 0.4 OUTLIER -128.53 144.61 51.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.5 179.593 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.0 pp -132.31 132.02 60.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.431 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 73.6 mt -80.62 125.92 30.61 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.643 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.425 ' HB3' ' HD2' ' A' ' 80' ' ' ARG . 0.2 OUTLIER -87.74 -63.85 1.24 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.093 -179.759 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.425 ' HD2' ' HB3' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -159.67 169.42 23.77 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.031 0.444 . . . . 0.0 111.381 179.775 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.403 ' CD1' ' N ' ' A' ' 82' ' ' GLY . 2.2 tm? -119.79 141.06 49.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.75 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.403 ' N ' ' CD1' ' A' ' 81' ' ' LEU . . . -157.03 -165.71 15.41 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.597 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 49.2 m -149.89 -175.48 5.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.787 0.327 . . . . 0.0 110.903 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 62.0 t-80 -68.51 -29.44 68.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.077 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.3 m -90.01 -23.67 21.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.187 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.11 -74.35 0.38 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.934 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 16.0 mt -68.39 -41.33 80.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.936 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.926 -179.958 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.8 mt . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.87 0.367 . . . . 0.0 110.857 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.18 148.23 36.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.828 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.1 tt -121.56 154.88 36.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.981 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -140.4 171.23 14.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.79 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.9 mp -139.68 129.3 24.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.991 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.4 169.46 8.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.847 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -29.92 67.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.002 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.2 m -77.11 -56.52 4.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.008 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.425 ' CE2' HD13 ' A' ' 78' ' ' LEU . 62.7 t80 -58.16 -33.58 69.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.048 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -61.26 -42.85 99.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.086 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.548 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 14.0 mttm -90.13 -16.59 29.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.565 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -90.78 -11.17 40.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.496 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.516 ' O ' HD11 ' A' ' 18' ' ' LEU . 25.4 t80 -90.84 -67.56 0.84 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.206 -179.596 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -90.84 -33.13 15.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.312 -0.404 . . . . 0.0 112.082 -179.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.548 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 2.9 mttt -74.53 -28.04 60.8 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.948 -179.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 30.6 tp -70.92 -35.77 72.39 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.536 HD12 ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -57.99 -33.17 68.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.66 179.812 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 mt -90.05 -6.86 55.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.435 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -96.07 27.15 3.77 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.713 0.292 . . . . 0.0 111.215 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.71 23.03 19.5 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.73 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.536 ' CD1' HD12 ' A' ' 18' ' ' LEU . 11.8 t80 -116.61 122.99 46.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.871 0.367 . . . . 0.0 110.774 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.424 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 14.6 t0 -66.65 128.84 37.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.898 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -78.1 -3.2 41.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.517 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.2 t -82.15 -27.32 32.8 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.685 0.279 . . . . 0.0 111.106 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.3 t -80.57 -36.65 16.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.439 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.0 pp -57.1 -37.37 71.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.056 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -57.76 -24.09 55.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.204 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -78.61 -35.37 45.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.112 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.416 HG11 ' CD1' ' A' ' 31' ' ' ILE . 11.5 p -90.1 -43.49 14.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.226 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.416 ' CD1' HG11 ' A' ' 30' ' ' VAL . 1.5 mp -58.39 -33.04 46.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.772 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.435 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -60.06 -56.64 19.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.641 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.403 ' N ' ' CD2' ' A' ' 32' ' ' LEU . 85.0 m -55.59 -24.05 30.69 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.378 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.1 mt -86.61 -34.4 19.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.759 0.314 . . . . 0.0 111.214 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -103.75 20.15 18.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.436 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.7 OUTLIER -116.14 21.12 13.93 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 -179.708 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.405 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 4.4 ptmm? 44.01 31.23 0.49 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.481 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -93.86 135.44 24.88 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.897 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -74.84 138.07 22.96 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.499 2.133 . . . . 0.0 112.284 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 33.4 mt -90.2 125.44 35.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.797 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -69.22 155.25 93.93 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.839 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -68.68 -10.24 28.5 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.557 2.171 . . . . 0.0 112.532 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.3 pp0? -86.3 7.5 25.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.438 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -92.98 13.91 19.26 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.599 0.238 . . . . 0.0 111.229 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 58.04 41.23 24.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.88 0.371 . . . . 0.0 111.041 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -86.93 111.79 21.16 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.98 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 11.7 m80 -164.72 -178.35 5.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.907 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -87.18 156.47 19.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.083 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 78.0 mt -109.02 176.92 4.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.934 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -124.8 152.65 43.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.876 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.461 ' C ' ' H ' ' A' ' 53' ' ' TRP . . . 60.91 111.11 0.01 OUTLIER Glycine 0 CA--C 1.508 -0.37 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.531 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 70.38 -44.27 0.57 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.748 0.309 . . . . 0.0 110.878 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.461 ' H ' ' C ' ' A' ' 51' ' ' GLY . 3.4 m0 -104.55 36.24 2.48 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.9 0.381 . . . . 0.0 110.915 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.445 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.1 OUTLIER -74.54 -49.95 4.76 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.159 -179.949 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.445 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 96.0 Cg_endo -84.7 28.99 0.55 Allowed 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.704 2.27 . . . . 0.0 113.018 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.402 ' CD1' ' O ' ' A' ' 55' ' ' PRO . 24.2 m-85 -139.8 170.42 15.92 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.742 0.306 . . . . 0.0 110.832 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 24.6 ttm180 -128.73 139.24 52.31 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.996 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -97.61 173.19 7.26 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.804 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -169.55 109.95 0.44 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.834 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.421 ' CE1' HD22 ' A' ' 66' ' ' LEU . 9.0 m170 -87.15 78.42 8.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.853 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.4 mp -58.26 -50.97 76.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.034 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.416 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 2.3 mmmt -115.98 171.73 4.4 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.729 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.416 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 14.3 Cg_exo -68.81 -2.19 9.02 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.681 2.254 . . . . 0.0 112.947 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -145.85 29.49 1.1 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.823 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 47.9 t -139.47 147.39 24.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.217 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.421 HD22 ' CE1' ' A' ' 60' ' ' HIS . 2.0 mt -147.35 92.15 2.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.777 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -85.15 131.78 34.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.979 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 96.9 t -109.84 116.05 51.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.042 179.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 21.7 p90 -134.33 156.35 48.62 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.233 -179.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.3 tp -111.74 -179.79 3.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.891 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.0 t -130.34 108.12 15.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.095 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.68 173.89 6.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.869 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -59.59 102.78 0.16 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.888 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 55.78 25.53 8.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.101 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 84.8 mt-10 -153.43 130.34 10.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.855 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -97.31 142.64 28.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.77 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.2 pp -129.26 136.29 59.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.305 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.425 HD13 ' CE2' ' A' ' 10' ' ' PHE . 70.6 mt -87.73 132.23 34.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.645 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.74 -61.29 1.75 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.093 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.99 162.89 4.72 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.921 0.391 . . . . 0.0 111.358 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -115.36 131.25 56.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.845 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -139.15 -162.08 8.98 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.498 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 95.7 p -147.8 169.62 19.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.865 0.364 . . . . 0.0 110.819 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -59.42 -28.95 67.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.962 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 18.4 m -90.11 -20.97 22.51 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.183 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -88.52 -75.0 0.44 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.09 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 46.2 mt -56.97 -41.99 79.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.227 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.255 -0.879 . . . . 0.0 111.025 179.998 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 11.6 mt . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.796 0.331 . . . . 0.0 110.838 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.82 138.29 58.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.829 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 8.5 tt -116.0 154.68 29.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.927 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -135.8 172.41 13.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.827 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.4 mp -139.7 123.13 17.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.918 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -98.55 160.25 14.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.8 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.8 tttp -59.72 -34.87 73.47 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.884 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.38 -25.08 63.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.026 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.419 ' CZ ' HD12 ' A' ' 78' ' ' LEU . 36.1 t80 -85.34 -33.9 21.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.979 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -58.73 -31.63 68.48 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.086 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.442 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 11.0 mtpp -90.34 -5.23 56.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.857 -179.597 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.45 ' HB2' ' HB3' ' A' ' 81' ' ' LEU . 17.1 p30 -90.69 -17.46 26.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.808 0.337 . . . . 0.0 111.466 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.46 ' CE2' ' CD1' ' A' ' 27' ' ' LEU . 30.2 t80 -91.18 -66.77 0.9 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.309 -179.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -91.3 -43.02 10.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.032 -179.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.442 ' HB3' ' O ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -71.24 -16.73 62.51 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.675 0.25 . . . . 0.0 111.675 -178.949 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.421 ' HB2' ' C ' ' A' ' 13' ' ' ASP . 1.5 tt -80.29 -36.89 33.75 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.014 0.435 . . . . 0.0 110.014 179.3 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.438 ' CD2' ' O ' ' A' ' 14' ' ' PHE . 0.4 OUTLIER -66.8 -42.65 85.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.785 179.707 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.9 mt -60.55 -41.0 93.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.888 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.82 -27.53 63.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.911 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.96 39.89 0.21 Allowed Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.537 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.417 ' CG ' HD22 ' A' ' 17' ' ' LEU . 76.4 t80 -119.75 154.09 34.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.815 0.34 . . . . 0.0 110.823 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -68.29 132.27 46.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.922 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.422 ' CB ' HD11 ' A' ' 18' ' ' LEU . 5.5 p-10 -90.64 -26.28 19.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.024 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.8 m -68.52 -32.13 71.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.319 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.409 ' CG1' ' CE2' ' A' ' 22' ' ' PHE . 14.1 p -67.85 -30.92 50.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.412 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.46 ' CD1' ' CE2' ' A' ' 14' ' ' PHE . 1.0 OUTLIER -63.88 -36.66 84.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.021 -179.839 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -64.38 -18.82 65.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.221 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -86.95 -36.71 18.16 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.094 -179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.403 HG11 ' CD1' ' A' ' 31' ' ' ILE . 13.3 p -86.05 -47.8 16.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.369 -179.768 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.403 ' CD1' HG11 ' A' ' 30' ' ' VAL . 1.7 mp -59.58 -40.12 81.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.958 0.408 . . . . 0.0 110.105 179.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.449 ' O ' ' HG2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -52.21 -62.9 1.34 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.804 179.78 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.429 ' N ' ' CD2' ' A' ' 32' ' ' LEU . 99.3 m -51.59 -41.0 60.87 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.788 0.328 . . . . 0.0 111.139 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 78.9 mt -59.2 -36.22 74.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.71 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.404 ' HB3' ' NH1' ' A' ' 35' ' ' ARG . 3.0 mtm105 -104.18 19.99 19.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.239 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.449 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 1.4 mmpt? -108.58 15.5 23.72 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.547 0.213 . . . . 0.0 111.496 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.6 mtmt 59.43 21.52 9.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.68 0.276 . . . . 0.0 110.604 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -89.36 110.76 41.14 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.15 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.62 115.03 4.18 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.445 2.097 . . . . 0.0 112.276 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.4 mt -61.39 140.62 58.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.89 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -74.09 154.59 88.56 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.894 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.21 -12.49 35.78 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.618 2.212 . . . . 0.0 112.499 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -87.22 8.89 22.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.409 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -90.49 10.07 26.77 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.695 -0.229 . . . . 0.0 111.218 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 64.19 41.7 5.98 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.912 0.387 . . . . 0.0 110.971 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -87.88 79.71 8.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.903 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -139.66 -179.81 6.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.838 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -81.17 123.58 28.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.185 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.2 mt -72.21 -177.52 2.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.846 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.2 mttt -125.25 171.14 10.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.802 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.03 -131.27 11.64 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.467 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 19.8 mttt -63.74 -31.45 72.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.719 0.295 . . . . 0.0 110.868 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -97.5 38.97 1.22 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.96 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.439 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 19.4 mttt -73.28 -50.31 6.45 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.09 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.439 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 4.7 Cg_exo -79.81 44.84 1.8 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.883 2.389 . . . . 0.0 112.464 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.404 ' CG ' ' O ' ' A' ' 55' ' ' PRO . 82.6 m-85 -156.7 178.29 10.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.831 0.348 . . . . 0.0 110.953 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.85 131.37 40.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.841 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -95.99 171.33 8.69 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.938 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 11.5 t -171.02 118.8 0.49 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.817 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.437 ' CD2' ' N ' ' A' ' 60' ' ' HIS . 4.2 m-70 -93.3 99.98 12.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.937 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.8 mp -70.42 -53.65 21.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.904 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.435 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 0.1 OUTLIER -112.64 172.25 3.68 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.49 179.757 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.435 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 18.1 Cg_exo -65.99 -4.6 10.48 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.51 2.14 . . . . 0.0 112.931 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -143.59 28.46 1.46 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.029 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 58.4 t -140.46 143.46 29.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.334 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -159.12 111.05 2.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.792 179.742 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.401 ' CB ' HD21 ' A' ' 81' ' ' LEU . 0.1 OUTLIER -113.48 134.45 54.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.865 -179.885 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.7 t -91.88 145.91 6.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.92 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 51.7 p90 -156.17 160.13 39.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.987 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 2.6 tp -109.32 161.24 15.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.824 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.9 t -120.92 100.62 9.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.084 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.56 166.32 23.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.817 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -40.45 -32.25 0.19 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.596 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -167.35 37.7 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.829 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -160.51 102.84 1.38 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.106 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.5 tt -67.92 134.96 51.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.66 179.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.2 pp -126.37 128.65 71.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.333 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.419 HD12 ' CZ ' ' A' ' 10' ' ' PHE . 82.5 mt -74.27 149.2 40.86 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.546 179.768 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -109.81 -71.03 0.78 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.261 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.403 ' HG3' ' N ' ' A' ' 81' ' ' LEU . 0.1 OUTLIER -157.59 159.21 36.84 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.163 0.506 . . . . 0.0 111.106 -179.744 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.45 ' HB3' ' HB2' ' A' ' 13' ' ' ASP . 2.9 tm? -113.79 136.78 52.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.535 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -157.46 173.33 34.91 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.654 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.5 m -108.73 170.27 8.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.839 0.352 . . . . 0.0 110.868 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -59.09 -26.72 64.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.059 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.7 t -83.79 -27.51 28.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.136 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -81.29 -69.74 0.59 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.022 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 35.1 mt -67.6 -37.87 83.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.002 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.207 -0.901 . . . . 0.0 110.892 -179.982 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.816 0.341 . . . . 0.0 110.922 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.52 146.62 39.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.979 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 7.3 tt -122.01 152.33 39.87 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.861 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -138.88 171.36 14.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.937 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.0 mp -147.12 116.69 7.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.919 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -79.82 171.14 15.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.851 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.3 ttpt -60.71 -31.24 70.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.942 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.1 m -72.99 -50.22 24.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.884 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -59.96 -35.7 75.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.812 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -63.41 -37.28 86.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.955 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.532 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 4.7 mmtt -89.16 -22.86 22.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.084 0.468 . . . . 0.0 111.097 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.417 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 4.9 m-20 -90.95 -11.11 40.01 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.232 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.51 ' O ' HD13 ' A' ' 18' ' ' LEU . 29.3 t80 -90.86 -67.38 0.85 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.833 0.349 . . . . 0.0 111.367 -179.558 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -91.09 -33.26 15.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.193 -179.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.532 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 12.6 mmtt -76.69 -26.79 55.13 Favored 'General case' 0 C--N 1.334 -0.096 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.161 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.417 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 29.2 tp -71.8 -33.01 68.19 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.185 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.556 HD11 ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -57.16 -33.58 67.56 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.821 179.967 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.7 mt -89.91 -3.32 58.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.454 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -97.7 26.81 4.77 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.669 0.271 . . . . 0.0 110.995 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 93.26 23.07 25.5 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.786 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.556 ' CD1' HD11 ' A' ' 18' ' ' LEU . 13.0 t80 -110.26 144.19 39.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.834 0.349 . . . . 0.0 110.797 179.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.419 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 5.1 t0 -99.61 113.4 25.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.004 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -58.1 -21.03 44.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.424 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.4 m -50.28 -54.43 21.34 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.775 0.322 . . . . 0.0 111.206 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.4 t -68.6 -34.62 66.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.984 0.421 . . . . 0.0 111.156 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.8 tp -65.56 -33.57 76.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.702 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -56.54 -57.92 10.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.128 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -50.5 -25.78 4.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.466 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 58.0 t -80.98 -68.25 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.911 0.386 . . . . 0.0 111.573 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.1 mp -51.38 -46.33 34.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.842 -179.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.96 -24.6 39.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.645 0.26 . . . . 0.0 111.314 -179.579 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.4 m -82.11 -30.43 31.17 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.053 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 mt -90.13 -28.57 18.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.459 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 14.0 mtm105 -94.16 20.11 8.43 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.692 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.466 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 4.2 mttt -118.19 -55.72 2.22 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.142 -0.223 . . . . 0.0 110.946 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.466 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 7.3 pttt 156.12 -20.53 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.965 179.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -59.44 111.47 3.84 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.955 -179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 158.73 56.03 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.368 2.046 . . . . 0.0 112.164 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 13.0 mt -82.64 116.03 21.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.905 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.405 ' HB2' ' CE2' ' A' ' 44' ' ' PHE . 83.3 m-20 -62.66 158.4 51.26 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.956 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.47 -11.33 30.97 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.626 2.217 . . . . 0.0 112.505 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -93.08 17.21 11.23 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.203 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.405 ' CE2' ' HB2' ' A' ' 41' ' ' ASP . 19.6 m-85 -98.04 6.67 47.36 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.261 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 44.5 mm-40 64.8 41.61 4.95 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.848 0.356 . . . . 0.0 110.889 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -86.62 90.4 8.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.933 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 70.2 m-70 -136.67 173.16 12.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.982 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.07 158.01 32.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.156 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.8 mp -112.07 -175.43 2.69 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.832 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.3 mttm -124.04 167.68 13.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.909 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 77.29 -133.27 13.02 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.497 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 10.8 mptt -60.45 -31.66 70.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.78 0.324 . . . . 0.0 110.854 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 17.1 m95 -98.63 38.69 1.33 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.973 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.5 -53.73 16.24 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.953 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.415 ' HG2' ' CE1' ' A' ' 56' ' ' PHE . 93.8 Cg_endo -84.94 34.62 0.51 Allowed 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.644 2.229 . . . . 0.0 112.609 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.415 ' CE1' ' HG2' ' A' ' 55' ' ' PRO . 81.3 m-85 -132.25 -175.45 3.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.878 0.371 . . . . 0.0 110.879 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.11 137.59 36.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.857 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -98.66 171.33 8.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.819 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 9.7 t -167.08 111.88 0.74 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.875 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.424 ' CG ' HD21 ' A' ' 66' ' ' LEU . 10.6 m170 -90.5 82.78 5.84 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.898 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.429 ' CD1' ' HB3' ' A' ' 67' ' ' LEU . 3.5 mp -56.13 -31.72 32.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.85 0.357 . . . . 0.0 110.93 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.411 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 0.0 OUTLIER -130.59 170.38 11.28 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.653 179.932 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.411 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 11.5 Cg_exo -70.75 0.96 5.59 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.852 2.368 . . . . 0.0 112.952 -179.667 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -147.27 27.46 1.03 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.788 0.328 . . . . 0.0 110.831 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 40.6 t -135.26 152.58 32.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.08 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.424 HD21 ' CG ' ' A' ' 60' ' ' HIS . 0.8 OUTLIER -146.98 104.2 3.67 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.693 179.771 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.429 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 4.2 tp -104.95 121.75 44.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.034 -179.66 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 46.3 t -99.08 135.93 32.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.794 179.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 46.4 p90 -153.3 161.97 41.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.051 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.4 tp -109.96 169.06 8.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.777 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.1 t -127.34 106.66 15.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.133 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.43 163.34 21.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.675 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -43.62 -40.82 4.29 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.467 -179.759 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -150.04 29.25 0.73 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.897 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -151.26 151.67 32.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.828 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 37.5 tp -115.09 137.14 52.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.691 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.0 pp -130.76 131.3 64.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.275 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 41.2 mt -82.66 136.9 34.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.788 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.408 ' HG ' ' CD2' ' A' ' 56' ' ' PHE . 0.3 OUTLIER -92.29 -71.29 0.65 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.982 -179.782 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.42 165.6 35.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.138 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -122.4 123.51 41.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.806 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -138.24 -169.59 11.63 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.416 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -140.29 -178.25 5.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.79 0.328 . . . . 0.0 110.865 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 5.6 t-80 -67.99 -28.71 67.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.032 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 17.9 m -89.95 -26.9 20.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.067 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.81 -68.6 0.68 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.048 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 16.6 mt -71.75 -38.6 70.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.068 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.903 -179.982 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.1 mt . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.869 0.366 . . . . 0.0 110.88 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.02 150.44 24.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.859 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 8.6 tt -116.09 144.84 43.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.086 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -133.67 -173.03 3.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.804 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.9 mp -143.91 140.77 29.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.96 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.8 165.58 11.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.819 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.84 -31.33 70.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.795 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.0 t -74.62 -47.8 30.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.941 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -59.53 -38.04 79.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.934 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -60.71 -35.11 75.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.931 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.541 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 7.3 mtmp? -85.94 -20.0 29.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.147 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -90.59 -11.51 39.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.282 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.457 ' O ' HD13 ' A' ' 18' ' ' LEU . 46.0 t80 -90.57 -66.97 0.88 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.225 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -90.96 -32.17 16.06 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.541 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -77.34 -27.29 52.67 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.263 -179.106 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.43 ' O ' ' HB3' ' A' ' 22' ' ' PHE . 1.1 tt -73.42 -33.62 65.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.936 0.398 . . . . 0.0 109.974 179.447 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.552 HD11 ' CD1' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -54.91 -42.58 72.36 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.111 -179.983 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 85.8 mt -82.88 -3.26 56.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.543 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.96 37.44 1.31 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.853 0.359 . . . . 0.0 110.983 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 82.86 25.65 48.67 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.387 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.552 ' CD1' HD11 ' A' ' 18' ' ' LEU . 8.9 t80 -116.35 132.18 56.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.755 0.312 . . . . 0.0 110.782 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.403 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 13.5 t0 -87.34 124.11 33.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.907 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -55.96 -27.43 52.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.069 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 72.7 m -57.09 -22.77 42.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.174 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.424 ' HB ' ' CZ ' ' A' ' 22' ' ' PHE . 27.1 t -83.64 -45.65 18.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.312 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.09 -35.64 73.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.905 -179.798 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -57.29 -26.75 61.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.859 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -73.89 -45.36 51.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.881 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.2 p -78.74 -47.99 22.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.274 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.4 mp -50.08 -35.95 11.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.928 0.394 . . . . 0.0 110.413 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.462 ' O ' ' CG ' ' A' ' 36' ' ' LYS . 1.0 OUTLIER -52.76 -62.6 1.54 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.419 179.448 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.401 ' N ' ' CD2' ' A' ' 32' ' ' LEU . 72.3 m -51.41 -25.74 6.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.552 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 18.8 mt -73.58 -66.54 0.68 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.789 0.328 . . . . 0.0 110.933 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.6 mtt180 -60.21 -52.0 67.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.78 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.528 ' O ' ' CG ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -68.16 -14.31 62.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.405 179.849 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.528 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 3.0 ptmt 51.96 69.17 0.7 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.583 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -79.18 136.17 57.42 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.601 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.93 104.81 0.2 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.423 2.082 . . . . 0.0 112.104 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 64.0 mt -67.47 127.76 33.89 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.009 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -80.89 157.93 71.01 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.841 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -64.49 -26.97 62.24 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 122.505 2.137 . . . . 0.0 112.239 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -62.24 -23.71 66.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.033 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -62.52 -18.48 62.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.172 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 63.82 41.76 6.59 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.822 0.344 . . . . 0.0 110.983 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -77.39 87.32 3.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.766 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -134.65 -177.67 4.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.934 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -90.43 124.2 34.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.209 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.422 HD13 ' CE3' ' A' ' 53' ' ' TRP . 15.6 mt -68.47 -177.38 0.92 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.796 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.0 mmtp -125.12 156.98 37.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.917 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 78.88 -116.85 4.43 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.552 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.9 tppt? -61.18 -30.23 70.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.742 0.306 . . . . 0.0 111.098 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.422 ' CE3' HD13 ' A' ' 49' ' ' LEU . 5.5 m-90 -114.41 47.88 1.18 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.937 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 1.4 tttt -79.59 -50.99 1.23 Allowed Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.256 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 83.4 Cg_endo -82.35 11.21 3.25 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.534 2.156 . . . . 0.0 112.853 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.421 ' CE1' HD11 ' A' ' 79' ' ' LEU . 95.6 m-85 -118.49 174.65 6.13 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.759 0.314 . . . . 0.0 110.972 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -125.42 127.15 46.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.952 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -95.98 156.38 16.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.742 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 16.5 t -160.02 131.97 6.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.785 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.427 ' CD2' HD21 ' A' ' 66' ' ' LEU . 3.4 m170 -111.04 90.83 3.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.964 -179.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.442 ' CD1' ' HB3' ' A' ' 67' ' ' LEU . 4.0 mp -55.4 -24.64 16.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.716 179.657 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.438 ' HB2' ' CD ' ' A' ' 63' ' ' PRO . 1.6 ptmt -155.15 169.82 9.67 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.392 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.438 ' CD ' ' HB2' ' A' ' 62' ' ' LYS . 16.3 Cg_exo -68.26 3.79 1.92 Allowed 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.688 2.259 . . . . 0.0 113.325 -179.463 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -138.31 30.38 2.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.703 0.287 . . . . 0.0 111.225 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 79.3 t -155.38 153.56 7.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.91 0.386 . . . . 0.0 111.244 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.427 HD21 ' CD2' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -150.34 86.91 1.42 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.481 179.657 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.442 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 4.3 tp -85.47 109.05 18.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.948 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 57.4 t -84.61 135.26 25.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.669 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -143.25 155.03 44.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.97 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -106.29 147.3 29.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.891 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.4 t -101.54 116.69 45.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.155 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.62 162.76 14.04 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.791 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -44.19 -48.89 9.3 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.594 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -139.24 29.66 2.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.971 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 -160.35 171.41 19.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.72 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.6 tp -130.9 148.59 52.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.785 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.1 pp -135.27 137.89 49.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.33 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 76.0 mt -81.68 133.58 35.37 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.651 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.421 HD11 ' CE1' ' A' ' 56' ' ' PHE . 0.3 OUTLIER -88.93 -70.42 0.65 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.972 -179.753 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -158.1 179.44 9.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.223 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -132.93 128.22 36.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.742 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -166.83 168.63 40.35 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.591 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 87.9 p -109.82 177.5 4.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.869 0.366 . . . . 0.0 110.71 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 14.7 t-80 -60.72 -26.69 67.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.007 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.44 -28.76 52.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.042 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -89.77 -71.82 0.59 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.022 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 29.0 mt -58.44 -42.94 88.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.04 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.833 179.971 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.4 mt . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.809 0.338 . . . . 0.0 110.963 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -104.28 151.51 23.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.894 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.7 tp -117.89 143.36 46.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.869 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -130.06 171.69 12.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.878 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.2 mp -135.51 115.35 13.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.838 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.2 mmtm -82.9 169.59 15.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.772 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.0 tttt -59.94 -31.06 69.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.891 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.1 m -73.37 -46.4 49.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.888 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -61.02 -29.95 70.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.896 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -59.22 -53.72 55.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.939 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.471 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 0.6 OUTLIER -78.33 -16.69 57.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.02 0.438 . . . . 0.0 111.31 -179.961 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.411 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 8.4 m-20 -90.52 -17.71 26.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.886 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.521 ' O ' HD11 ' A' ' 18' ' ' LEU . 76.9 t80 -90.94 -68.34 0.8 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.335 -179.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.44 ' HA ' HD22 ' A' ' 18' ' ' LEU . 15.3 m-20 -90.82 -41.57 11.14 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -178.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.471 ' HB3' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -69.96 -23.92 63.25 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.205 -179.014 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.411 ' HB2' ' HA ' ' A' ' 13' ' ' ASP . 25.7 tp -73.07 -35.6 66.69 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.521 HD11 ' O ' ' A' ' 14' ' ' PHE . 0.1 OUTLIER -58.08 -43.44 87.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.854 179.855 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 20.2 mt -79.81 -4.69 53.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.393 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.69 22.85 7.59 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.759 0.314 . . . . 0.0 111.153 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 96.78 23.04 16.48 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.823 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.509 ' CD1' HD12 ' A' ' 18' ' ' LEU . 11.1 t80 -114.19 137.45 51.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.813 0.34 . . . . 0.0 110.839 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.424 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 1.9 t0 -92.68 119.65 32.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.033 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -59.17 -19.01 41.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.473 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.4 p -46.82 -49.08 20.59 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 120.698 0.285 . . . . 0.0 111.309 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.7 t -74.53 -34.61 35.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.985 0.422 . . . . 0.0 111.111 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.6 tp -64.72 -39.01 92.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.722 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -54.85 -41.94 71.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.18 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -69.8 -12.22 61.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.393 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 77.7 t -90.43 -70.94 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.847 0.356 . . . . 0.0 111.693 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.4 mp -49.46 -40.0 14.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.036 -179.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.421 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 0.3 OUTLIER -62.4 -14.63 42.47 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.369 -179.669 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 92.9 m -90.08 -30.11 17.91 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.744 0.307 . . . . 0.0 110.866 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.9 mt -88.64 -31.63 18.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.398 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 31.8 mtm180 -93.21 20.21 7.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.338 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.464 ' O ' ' CG ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -123.47 24.46 8.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.831 0.348 . . . . 0.0 111.341 -179.821 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.464 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 3.9 pttp 46.71 47.21 15.01 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.319 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -123.82 109.89 29.9 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.786 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -66.35 135.75 40.88 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.396 2.064 . . . . 0.0 112.238 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.7 mt -64.03 -178.99 0.37 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.847 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.07 160.49 38.87 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.909 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.53 -18.34 48.85 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.601 2.201 . . . . 0.0 112.438 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.59 -1.64 38.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.523 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.432 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.3 m-85 -78.41 -3.01 41.12 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.61 0.243 . . . . 0.0 111.401 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 62.39 43.62 7.96 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.883 0.373 . . . . 0.0 110.866 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -88.43 100.46 13.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.907 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 75.7 m80 -133.22 173.37 11.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.95 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -81.09 131.86 35.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.072 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 7.1 mt -81.21 -178.78 7.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.875 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.21 157.09 41.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.879 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.458 ' C ' ' H ' ' A' ' 53' ' ' TRP . . . 60.31 109.93 0.01 OUTLIER Glycine 0 CA--C 1.508 -0.402 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.516 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 70.22 -44.87 0.58 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.667 0.27 . . . . 0.0 110.966 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.458 ' H ' ' C ' ' A' ' 51' ' ' GLY . 8.3 m95 -105.09 35.7 2.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.881 0.372 . . . . 0.0 110.887 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.438 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.1 OUTLIER -68.21 -52.82 20.86 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.141 179.975 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.438 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 71.6 Cg_endo -77.79 4.51 6.01 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.435 2.09 . . . . 0.0 112.699 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.422 ' CD2' ' HG ' ' A' ' 79' ' ' LEU . 30.6 m-85 -104.0 172.62 6.7 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.832 0.348 . . . . 0.0 110.806 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 57.1 ttm-85 -133.03 137.6 46.51 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.918 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -98.96 172.32 7.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.863 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 17.7 t -166.13 129.47 2.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.76 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.453 ' CD2' ' N ' ' A' ' 60' ' ' HIS . 2.5 m-70 -99.52 84.38 2.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.067 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.432 ' HA ' ' CD2' ' A' ' 44' ' ' PHE . 2.9 mp -58.17 -28.32 34.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.031 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.42 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 14.7 mttt -137.34 168.26 17.32 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.658 -179.86 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.42 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 42.5 Cg_endo -67.61 -3.19 9.77 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.397 2.065 . . . . 0.0 112.824 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -145.04 28.6 1.23 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.656 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 51.8 t -137.73 145.79 28.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.282 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.428 HD21 ' CE1' ' A' ' 60' ' ' HIS . 6.7 mt -140.32 119.78 13.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.547 179.392 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.413 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 4.8 tp -116.16 127.88 55.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.227 -179.489 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 46.0 t -103.97 138.09 29.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.479 179.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 46.0 p90 -151.78 164.77 36.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.914 0.387 . . . . 0.0 110.993 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.3 tp -114.37 179.69 3.88 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.851 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.6 t -122.07 111.47 30.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.03 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.32 168.29 9.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.962 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -62.05 106.47 0.72 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.846 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.3 t0 58.4 21.6 8.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.103 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -156.6 147.79 22.19 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.85 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.2 tt -111.97 147.88 34.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.873 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.1 pp -130.76 135.66 59.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.227 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 89.4 mt -84.0 148.67 26.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.707 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.422 ' HG ' ' CD2' ' A' ' 56' ' ' PHE . 0.7 OUTLIER -103.45 -68.38 0.84 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.968 -179.89 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.65 171.09 19.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.073 0.464 . . . . 0.0 111.303 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -124.57 131.92 53.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.683 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -150.6 -161.91 10.27 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.712 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -139.39 168.84 18.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.81 0.338 . . . . 0.0 110.824 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -59.23 -27.78 66.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.12 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.4 m -89.99 -18.62 25.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.302 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -84.66 -67.62 0.78 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.789 0.328 . . . . 0.0 111.233 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 7.0 mp -52.52 -32.1 38.8 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.327 -179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.885 -179.999 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.1 mp . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.904 0.383 . . . . 0.0 111.051 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.36 163.06 3.24 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.651 179.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.3 tt -125.65 145.27 50.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.889 0.376 . . . . 0.0 110.985 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -134.15 -176.64 4.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.988 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.7 mt -145.76 136.14 24.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.907 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -104.89 171.41 7.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.816 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.43 -34.07 72.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.937 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.9 m -66.04 -31.55 72.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.915 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.8 t80 -77.26 -32.75 55.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.915 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 87.8 mm-40 -69.94 -28.98 66.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.155 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.5 pttt -90.15 -53.26 4.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.241 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -53.61 -25.51 17.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.032 0.444 . . . . 0.0 111.133 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.448 ' CZ ' HD23 ' A' ' 27' ' ' LEU . 51.6 t80 -64.14 -71.21 0.18 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.724 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.403 ' OD1' ' CD2' ' A' ' 14' ' ' PHE . 1.0 OUTLIER -68.0 -26.21 65.79 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.427 179.121 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.3 ttmm -69.97 -31.02 68.52 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.675 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.448 ' O ' ' HB3' ' A' ' 22' ' ' PHE . 33.2 tp -90.28 -40.32 12.22 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 179.089 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.556 ' N ' HD12 ' A' ' 18' ' ' LEU . 4.7 mp -53.45 -36.27 61.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.01 179.759 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.5 pp -90.08 -9.89 46.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.525 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -93.48 37.17 1.06 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.656 0.265 . . . . 0.0 111.204 -179.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.81 23.03 40.24 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.843 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.451 ' CD1' HD13 ' A' ' 18' ' ' LEU . 34.7 t80 -116.77 112.11 20.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.838 0.352 . . . . 0.0 110.783 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -57.52 146.46 29.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.083 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 20.3 p-10 -86.31 -11.31 52.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.18 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.9 t -78.62 -27.27 45.45 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.7 0.286 . . . . 0.0 110.998 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.414 HG11 ' CE1' ' A' ' 22' ' ' PHE . 10.0 p -80.02 -27.43 12.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.326 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.448 HD23 ' CZ ' ' A' ' 14' ' ' PHE . 1.5 pp -59.13 -38.57 79.97 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.107 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 15.8 t30 -59.23 -23.9 62.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.176 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -80.05 -45.32 18.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.145 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.409 ' CG2' ' CD1' ' A' ' 61' ' ' ILE . 12.4 p -77.69 -48.39 24.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.45 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.2 mp -57.05 -29.72 32.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.901 0.381 . . . . 0.0 110.43 179.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.523 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -61.36 -65.85 0.63 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.273 179.382 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.414 ' N ' ' CD2' ' A' ' 32' ' ' LEU . 85.4 m -46.23 -24.26 0.44 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.937 -179.72 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.3 mt -89.29 -49.79 6.51 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -179.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 35.3 mtt180 -83.26 -16.82 44.85 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -178.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.523 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -94.38 18.88 10.36 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.624 0.249 . . . . 0.0 111.45 -179.619 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.434 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 1.3 ptpp? 45.49 48.37 10.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.33 179.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -90.63 136.97 27.41 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.783 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -68.07 137.08 39.83 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.453 2.102 . . . . 0.0 112.288 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.6 mt -96.15 148.33 22.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.911 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.37 164.07 21.19 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.92 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.41 -29.66 45.24 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.578 2.185 . . . . 0.0 112.252 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -19.67 65.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.101 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.416 ' CE2' ' HA ' ' A' ' 61' ' ' ILE . 4.8 m-85 -62.64 -17.87 61.22 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.234 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 73.8 mm-40 66.73 38.72 3.8 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.874 0.368 . . . . 0.0 110.881 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -76.75 122.11 24.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.893 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -168.0 -178.08 3.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.877 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.19 134.76 36.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.027 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.2 mt -70.11 -176.64 1.19 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.928 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.78 -178.32 3.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.967 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 65.81 -140.47 40.4 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.528 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.0 -7.65 54.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.532 0.206 . . . . 0.0 111.369 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 5.0 m95 -96.17 37.6 1.24 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.88 0.372 . . . . 0.0 110.832 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.478 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -69.88 -50.24 17.82 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.407 179.997 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.478 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 64.0 Cg_endo -74.58 51.62 2.67 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.175 1.916 . . . . 0.0 112.66 -179.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -152.99 175.59 12.79 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.761 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.24 144.62 44.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.922 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -113.26 171.63 7.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.749 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 8.2 t -168.34 110.75 0.57 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.925 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.415 ' CE1' HD21 ' A' ' 66' ' ' LEU . 10.8 m170 -84.9 83.62 7.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.94 179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.416 ' HA ' ' CE2' ' A' ' 44' ' ' PHE . 4.0 mp -53.63 -27.59 15.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.037 179.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.43 ' HB2' ' CD ' ' A' ' 63' ' ' PRO . 0.0 OUTLIER -159.49 169.74 9.93 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.382 179.714 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.43 ' CD ' ' HB2' ' A' ' 62' ' ' LYS . 15.3 Cg_exo -68.77 5.52 1.31 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.705 2.27 . . . . 0.0 113.29 -179.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -138.9 24.69 2.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.56 0.219 . . . . 0.0 111.39 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 42.0 t -155.35 145.68 12.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 121.036 0.446 . . . . 0.0 111.603 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.415 HD21 ' CE1' ' A' ' 60' ' ' HIS . 15.7 mt -141.68 107.52 5.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.428 179.506 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.403 ' C ' ' CD1' ' A' ' 67' ' ' LEU . 2.5 tm? -99.84 134.05 43.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.933 0.397 . . . . 0.0 111.365 -179.608 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 98.6 t -113.12 119.93 61.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.879 178.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 20.3 p90 -132.97 155.7 48.65 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.953 0.406 . . . . 0.0 111.323 -179.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.6 tp -109.54 171.09 7.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.852 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 20.2 t -122.93 104.98 15.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.262 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.0 164.41 24.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.776 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -41.94 -36.19 1.03 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.55 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -157.48 27.63 0.29 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.864 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -151.36 162.75 40.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.816 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.5 tp -114.03 147.6 38.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.583 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.2 pp -136.4 126.55 40.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.373 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 78.5 mt -80.32 115.68 19.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.55 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.5 -66.58 0.64 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.09 -179.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.77 176.06 9.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.049 0.452 . . . . 0.0 111.331 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -131.86 117.44 18.51 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.714 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -120.71 -161.15 11.34 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.58 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.8 m -134.19 153.01 52.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.069 0.461 . . . . 0.0 110.912 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -49.42 -28.48 5.23 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.344 -179.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 12.7 t -90.19 -20.67 22.77 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.239 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.5 -71.22 0.47 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.152 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.3 mp -49.93 -27.46 5.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.372 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.215 -0.897 . . . . 0.0 110.916 179.982 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 7.1 mt . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.789 0.328 . . . . 0.0 111.008 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.85 146.94 40.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.874 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.2 148.3 42.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.912 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -133.56 171.14 14.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.917 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.429 HD21 ' CD1' ' A' ' 10' ' ' PHE . 4.1 mt -137.97 104.13 5.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.9 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -78.41 165.94 23.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.816 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -60.39 -38.85 85.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.812 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.8 t -68.85 -31.45 70.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.924 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.429 ' CD1' HD21 ' A' ' 6' ' ' LEU . 56.0 t80 -80.92 -37.34 29.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.936 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -57.22 -36.33 70.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.974 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.458 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 4.7 mtpm? -90.06 -17.87 26.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.14 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.42 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 3.9 m-20 -90.53 -17.26 27.34 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.276 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.5 ' O ' HD12 ' A' ' 18' ' ' LEU . 65.9 t80 -91.1 -68.43 0.79 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.425 -179.658 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.41 ' HA ' HD23 ' A' ' 18' ' ' LEU . 1.3 t0 -90.95 -40.9 11.43 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.458 ' HB3' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -70.36 -26.46 63.74 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.677 -0.409 . . . . 0.0 111.086 -179.117 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.42 ' HB2' ' HA ' ' A' ' 13' ' ' ASP . 20.5 tp -69.8 -33.32 72.2 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 179.012 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.512 HD13 ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -61.36 -30.77 70.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.802 179.904 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 21.6 mt -86.36 -32.8 20.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.066 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -60.89 -19.48 60.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.075 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 133.04 34.04 0.35 Allowed Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.574 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.512 ' CD1' HD13 ' A' ' 18' ' ' LEU . 12.1 t80 -113.2 146.51 39.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.737 0.303 . . . . 0.0 110.726 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.432 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 43.0 t0 -95.08 106.79 18.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.012 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -51.91 -24.99 7.13 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.317 -179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -50.68 -44.06 57.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.788 0.328 . . . . 0.0 111.158 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.6 t -77.28 -35.82 23.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.003 0.43 . . . . 0.0 111.059 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.9 tp -59.79 -40.31 87.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.641 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 34.0 t30 -55.94 -42.45 76.19 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.053 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -61.77 -16.62 51.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.4 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 60.8 t -90.33 -70.4 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.814 0.34 . . . . 0.0 111.807 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.2 mp -50.66 -36.47 14.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.121 -0.49 . . . . 0.0 112.219 -178.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.526 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 0.3 OUTLIER -67.24 -11.19 56.8 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 120.909 -0.316 . . . . 0.0 111.352 -179.869 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 86.3 m -90.57 -35.84 14.8 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.925 0.393 . . . . 0.0 111.048 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.7 mt -90.06 -65.04 1.05 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.912 -179.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.2 mtt180 -49.54 -21.99 1.13 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.106 -179.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -90.49 21.25 4.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.638 0.256 . . . . 0.0 111.526 -179.882 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.438 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 0.2 OUTLIER 46.1 61.66 2.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.007 0.432 . . . . 0.0 111.513 -179.935 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -119.58 144.07 36.07 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.746 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.0 141.56 40.46 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.423 2.082 . . . . 0.0 112.379 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.413 HD21 ' CE2' ' A' ' 44' ' ' PHE . 54.0 mt -84.73 141.07 30.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.925 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.29 159.47 77.67 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.874 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -61.55 -27.03 81.38 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.603 2.202 . . . . 0.0 112.241 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -64.21 -26.54 68.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.971 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.436 ' CE2' ' HA ' ' A' ' 61' ' ' ILE . 3.1 m-30 -58.25 -53.53 57.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.76 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 60.91 83.53 0.14 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.959 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -92.53 105.35 17.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.878 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -130.69 -177.2 4.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.914 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -95.07 136.65 35.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.087 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.5 mp -70.11 -168.38 0.21 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.84 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.3 mmtt -137.8 150.34 47.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.791 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.427 ' C ' ' H ' ' A' ' 53' ' ' TRP . . . 60.39 110.52 0.01 OUTLIER Glycine 0 CA--C 1.507 -0.413 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.655 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.7 tptm 70.15 -45.67 0.59 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.713 0.292 . . . . 0.0 110.953 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.427 ' H ' ' C ' ' A' ' 51' ' ' GLY . 90.9 m95 -98.95 33.25 2.4 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.964 0.412 . . . . 0.0 110.822 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.461 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 1.3 tttm -70.1 -49.41 18.6 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.673 -179.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 72.9 Cg_endo -77.31 5.85 4.79 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.419 2.079 . . . . 0.0 113.191 -179.481 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -110.06 173.36 6.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.824 0.345 . . . . 0.0 110.959 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.4 ' HB2' ' NH1' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -129.04 144.53 51.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.956 -179.858 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -106.45 179.36 4.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.888 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.6 t -170.96 120.99 0.54 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.834 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.404 ' CD2' ' N ' ' A' ' 60' ' ' HIS . 13.7 m170 -99.2 78.66 2.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.976 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.441 ' CD1' ' HB3' ' A' ' 67' ' ' LEU . 2.9 mp -59.6 -29.14 41.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.113 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.1 mtpt -135.84 168.73 16.02 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.85 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -70.03 -1.08 8.1 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.871 2.38 . . . . 0.0 112.931 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 -143.06 26.66 1.66 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.704 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 42.8 t -137.26 150.93 26.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.107 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.1 mt -147.91 87.5 1.62 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.614 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.441 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 6.4 tp -82.94 134.31 35.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.115 -179.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.411 HG11 ' N ' ' A' ' 69' ' ' TYR . 38.8 t -113.38 140.29 34.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.665 179.69 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.411 ' N ' HG11 ' A' ' 68' ' ' VAL . 52.1 p90 -155.49 162.86 40.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.111 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 2.2 tp -112.35 173.08 6.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.833 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -127.42 102.33 8.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.205 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.34 164.57 26.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.798 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -43.44 -43.91 5.54 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.58 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -145.12 26.39 1.34 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.994 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -150.46 167.36 27.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.798 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.1 tt -126.15 134.81 51.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.727 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.4 pp -125.73 132.53 70.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.446 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 92.5 mt -77.8 139.28 39.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.605 179.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -94.0 -64.56 1.07 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.013 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -168.75 171.47 8.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.988 0.423 . . . . 0.0 111.206 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -128.54 121.61 29.18 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.696 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -137.42 -165.97 10.59 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.642 -0.789 . . . . 0.0 112.575 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.4 m -152.43 -171.55 3.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.904 0.383 . . . . 0.0 110.822 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 -73.39 -28.45 62.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.044 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.47 -23.21 22.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.13 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -89.89 -68.75 0.76 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.984 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 72.8 mt -59.1 -42.84 91.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.94 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.226 -0.892 . . . . 0.0 110.911 -179.959 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 21.0 mt . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.838 0.352 . . . . 0.0 110.961 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.86 150.98 26.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.866 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.5 tt -122.08 144.89 48.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.977 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -130.56 179.18 6.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.955 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -140.64 121.87 14.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.911 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -92.87 168.85 10.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.929 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -65.53 -41.17 93.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.836 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.72 -32.83 74.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.856 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 51.8 t80 -69.72 -30.87 68.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.873 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -63.88 -50.82 67.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.946 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.525 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 46.6 mttp -76.5 -14.16 60.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.993 0.425 . . . . 0.0 111.264 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.419 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 3.8 m-20 -90.42 -11.78 39.42 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.798 179.551 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.481 ' O ' ' CD1' ' A' ' 18' ' ' LEU . 37.1 t80 -90.77 -74.97 0.48 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.138 -179.687 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -90.39 -31.79 16.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.842 -179.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.525 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -77.03 -13.1 60.0 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.626 -0.429 . . . . 0.0 110.816 -179.948 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.419 ' HB2' ' HA ' ' A' ' 13' ' ' ASP . 27.2 tp -86.98 -30.99 20.84 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 178.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.481 ' CD1' ' O ' ' A' ' 14' ' ' PHE . 4.2 mp -45.57 -51.27 12.22 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.309 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.5 pp -72.42 -6.44 43.55 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.001 -179.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.2 t30 -93.29 37.63 1.04 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.745 0.307 . . . . 0.0 111.051 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.73 23.11 70.6 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.24 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.464 ' CD1' HD12 ' A' ' 18' ' ' LEU . 51.7 t80 -109.78 124.78 51.88 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.833 0.349 . . . . 0.0 110.832 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.42 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 18.0 t0 -64.67 141.36 58.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.927 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -94.0 -20.62 19.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.352 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.6 m -76.64 -26.43 54.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.831 0.348 . . . . 0.0 111.286 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 13.7 p -78.76 -33.29 16.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.373 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 pp -62.04 -36.95 83.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.043 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -58.89 -24.81 62.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.046 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.407 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 9.8 mt-10 -75.62 -33.95 60.54 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.1 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.4 p -90.7 -34.52 6.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.557 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.5 mp -70.56 -48.05 61.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.749 -179.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.496 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 0.5 OUTLIER -60.19 -16.08 29.98 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.523 0.194 . . . . 0.0 111.523 -179.395 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 88.6 m -90.18 -26.63 20.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.659 0.266 . . . . 0.0 111.115 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.5 mt -87.32 -46.72 9.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.398 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 68.8 mtp180 -74.22 -5.49 42.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.794 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -97.97 25.29 6.14 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.757 0.313 . . . . 0.0 111.438 -179.661 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.471 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 53.6 pttt 46.53 29.96 1.01 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.24 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -90.25 130.55 41.56 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.791 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -75.89 148.94 32.56 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.442 2.095 . . . . 0.0 112.422 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 16.0 mt -90.59 142.24 27.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.888 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.423 ' HB2' ' CE1' ' A' ' 44' ' ' PHE . 1.6 m-20 -73.71 157.25 87.72 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.03 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.6 -9.76 26.47 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.604 2.203 . . . . 0.0 112.557 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -96.23 30.97 2.31 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.766 0.317 . . . . 0.0 110.94 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.428 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.3 m-30 -100.42 -11.17 20.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.305 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 65.95 44.92 2.6 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.851 0.358 . . . . 0.0 110.925 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.9 p-10 -89.15 76.93 7.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.888 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -119.82 176.79 5.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.915 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.91 136.25 38.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.064 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.5 mp -78.13 -172.69 2.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.914 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.0 mmtm -130.41 171.39 13.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.95 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.19 -128.17 11.47 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.5 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.7 mmtp -69.98 -23.25 63.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.705 0.288 . . . . 0.0 110.978 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 18.9 m-90 -96.68 31.82 2.22 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.889 0.376 . . . . 0.0 110.998 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.427 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.2 OUTLIER -66.12 -51.45 45.3 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.064 179.905 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.427 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 98.7 Cg_endo -80.09 46.56 2.27 Favored 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.422 2.081 . . . . 0.0 112.487 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -154.96 179.11 9.44 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.918 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 -139.69 138.98 36.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.872 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -98.44 176.77 5.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.425 ' HB2' ' CZ ' ' A' ' 69' ' ' TYR . 12.0 t -170.72 102.64 0.24 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.881 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.42 ' CD2' HD23 ' A' ' 66' ' ' LEU . 10.7 m170 -83.2 82.98 8.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.032 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.433 ' CD1' ' HB3' ' A' ' 67' ' ' LEU . 2.7 mp -61.65 -35.12 65.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.077 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.408 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 7.6 mmmt -131.03 169.32 14.02 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.673 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.408 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 16.9 Cg_exo -66.83 -5.29 12.95 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.634 2.223 . . . . 0.0 112.79 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -142.92 27.48 1.63 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.829 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 98.0 t -135.52 137.98 48.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.177 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.42 HD23 ' CD2' ' A' ' 60' ' ' HIS . 9.0 mt -139.86 93.79 2.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.794 179.559 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.433 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 2.6 tp -92.36 119.24 31.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.844 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 50.3 t -93.74 136.05 26.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.021 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.425 ' CZ ' ' HB2' ' A' ' 59' ' ' CYS . 2.2 p90 -147.8 158.61 44.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.759 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -104.28 144.35 31.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.866 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 8.7 p -82.83 158.96 3.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.021 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.44 155.84 31.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.926 179.599 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.67 107.29 0.49 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.003 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 58.29 23.41 10.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.116 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -158.1 154.66 27.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.886 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.6 tp -133.89 140.24 46.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.723 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.0 pp -122.64 134.61 65.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.189 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 71.3 mt -74.19 151.94 39.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.912 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.62 -68.62 0.92 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.884 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.62 168.81 25.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.078 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -118.63 133.95 55.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.733 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -150.3 -164.57 11.96 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.58 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.4 p -144.48 171.78 13.88 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.724 0.297 . . . . 0.0 110.832 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -58.65 -28.33 65.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.016 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.2 t -86.38 -30.05 22.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.94 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.37 -74.93 0.31 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.906 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 34.7 mt -60.25 -34.61 73.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.854 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.85 179.982 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.1 mt . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.722 0.296 . . . . 0.0 110.98 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.66 156.47 13.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.908 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 7.1 tt -124.68 151.37 45.03 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.977 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -138.13 174.28 10.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.852 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.0 mt -127.67 142.58 51.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.871 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.5 mmpt? -112.93 164.55 13.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.907 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.3 pttt -54.71 -53.21 57.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.183 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.8 m -57.62 -37.68 73.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.121 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.43 ' CZ ' HD11 ' A' ' 78' ' ' LEU . 36.0 t80 -62.45 -27.69 69.29 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.99 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -77.7 -38.47 47.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.092 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.412 ' O ' ' CB ' ' A' ' 16' ' ' LYS . 6.1 ptmt -89.96 -8.59 51.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.601 -179.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -90.44 -23.52 20.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.792 0.33 . . . . 0.0 111.116 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.462 ' CE1' HD23 ' A' ' 18' ' ' LEU . 37.1 t80 -90.29 -68.86 0.76 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.439 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -49.96 -33.07 16.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.995 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.412 ' CB ' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -79.45 -23.66 42.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.862 179.715 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.451 ' HG ' ' CG ' ' A' ' 22' ' ' PHE . 36.6 tp -86.46 -50.53 6.81 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.462 HD23 ' CE1' ' A' ' 14' ' ' PHE . 4.2 mm? -50.55 -36.08 32.77 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.1 179.749 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 27.0 mt -90.01 -7.75 53.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.798 -179.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -93.77 35.85 1.12 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.877 0.37 . . . . 0.0 111.149 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 80.11 22.85 62.42 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.684 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.451 ' CG ' ' HG ' ' A' ' 17' ' ' LEU . 71.7 t80 -98.72 107.96 20.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.783 0.325 . . . . 0.0 110.609 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -52.77 124.13 13.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.037 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -62.43 -38.4 89.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.119 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.6 t -54.1 -24.59 18.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.245 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 34.5 t -79.61 -35.48 16.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.286 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.67 -35.99 71.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.954 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -63.7 -15.86 59.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.36 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -90.1 -35.58 15.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.694 0.283 . . . . 0.0 111.328 -179.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.0 p -90.63 -36.05 7.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -179.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.6 mp -76.21 -42.07 37.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 111.642 0.238 . . . . 0.0 111.642 -179.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.532 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -64.51 -14.37 56.97 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.447 -179.553 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.411 ' N ' HD21 ' A' ' 32' ' ' LEU . 99.9 m -90.36 -25.68 20.32 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 120.767 0.317 . . . . 0.0 110.904 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.8 mt -86.3 -36.78 19.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.555 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.6 mtp-105 -93.5 20.36 7.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.643 -179.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.532 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -126.85 18.71 7.24 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.598 0.222 . . . . 0.0 111.598 -179.793 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.458 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 12.4 pttm 45.72 30.01 0.76 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.907 0.384 . . . . 0.0 111.085 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.02 148.13 78.11 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.9 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -74.44 161.4 40.19 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.5 2.133 . . . . 0.0 112.463 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.2 mt -130.14 123.4 30.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.991 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.61 156.91 29.86 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.914 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -62.34 -24.17 75.63 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.543 2.162 . . . . 0.0 112.281 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.51 -23.7 67.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.037 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.423 ' O ' ' CD2' ' A' ' 60' ' ' HIS . 44.6 m-85 -69.34 -10.54 58.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.455 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 58.91 34.69 23.79 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.861 0.362 . . . . 0.0 111.066 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -66.4 78.11 0.1 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.837 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 73.1 m80 -138.95 177.62 7.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.019 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.31 137.02 44.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.09 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.89 -171.09 1.22 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.819 179.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -144.1 149.78 37.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.929 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.418 ' C ' ' H ' ' A' ' 53' ' ' TRP . . . 65.98 109.17 0.01 OUTLIER Glycine 0 CA--C 1.506 -0.474 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.841 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.4 mptt 69.18 -45.95 0.56 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.528 0.204 . . . . 0.0 111.181 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.418 ' H ' ' C ' ' A' ' 51' ' ' GLY . 17.8 m95 -101.95 33.93 2.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.855 0.359 . . . . 0.0 111.073 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.441 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 22.9 tttm -64.15 -49.42 73.66 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.303 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.441 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 89.1 Cg_endo -79.76 46.89 2.35 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.362 2.041 . . . . 0.0 112.745 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.417 ' CE1' HD11 ' A' ' 79' ' ' LEU . 69.1 m-85 -153.02 -176.51 5.8 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.732 0.301 . . . . 0.0 110.962 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 18.5 ttm105 -137.33 141.99 41.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.153 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -106.81 161.97 14.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.793 179.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 9.1 t -171.27 100.24 0.2 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.906 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.44 ' O ' ' CG ' ' A' ' 60' ' ' HIS . 26.8 p80 -86.58 108.56 18.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.067 0.461 . . . . 0.0 110.827 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.6 mp -77.53 -31.9 18.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.852 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.521 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 5.6 mmtp -128.05 161.5 55.61 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.293 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.521 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 29.0 Cg_endo -62.98 -6.02 8.73 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.307 2.005 . . . . 0.0 112.747 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -135.84 25.81 3.34 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.694 179.556 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 54.8 t -137.33 146.76 27.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.137 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.7 mt -144.25 102.94 3.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.731 179.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.409 ' C ' ' CD1' ' A' ' 67' ' ' LEU . 3.3 tm? -92.58 131.19 37.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.008 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 87.5 t -109.84 115.59 50.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.828 178.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 27.2 p90 -128.19 149.96 50.22 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.268 -179.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.411 HD12 ' CE1' ' A' ' 56' ' ' PHE . 0.4 OUTLIER -113.73 155.23 25.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.857 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -107.04 129.95 59.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.176 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.47 173.2 7.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.784 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -56.92 101.93 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.912 0.387 . . . . 0.0 110.981 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 54.85 23.48 4.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.149 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -150.68 133.91 16.2 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.938 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.6 tp -105.04 152.09 23.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.755 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.0 pp -138.29 142.89 34.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.429 -179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.43 HD11 ' CZ ' ' A' ' 10' ' ' PHE . 58.1 mt -93.81 123.31 37.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.434 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.417 HD11 ' CE1' ' A' ' 56' ' ' PHE . 0.1 OUTLIER -77.44 -60.37 2.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.078 -179.635 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.87 167.05 4.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.081 0.467 . . . . 0.0 111.65 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.402 ' CD1' ' N ' ' A' ' 82' ' ' GLY . 2.9 tm? -116.8 143.52 45.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.582 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.402 ' N ' ' CD1' ' A' ' 81' ' ' LEU . . . -165.93 -165.63 23.59 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.841 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.0 p -138.84 -178.84 5.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.764 0.316 . . . . 0.0 110.795 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -62.89 -23.42 67.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.182 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.7 m -83.29 -30.19 27.76 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.163 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -86.03 -67.95 0.77 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.014 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.6 mp -56.15 -32.39 64.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.055 -179.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.941 -179.96 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 7.1 mt . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.924 0.393 . . . . 0.0 110.835 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.61 145.95 50.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.824 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -113.59 151.43 31.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.945 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -137.13 -173.01 3.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.764 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.0 mp -144.73 136.84 26.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.976 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.55 172.7 6.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.938 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.2 mtmt -67.96 -46.16 72.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.949 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 35.3 m -59.69 -42.41 92.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.872 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.422 ' CZ ' HD13 ' A' ' 78' ' ' LEU . 11.5 t80 -60.54 -36.85 79.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.746 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -63.53 -47.47 81.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.845 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.538 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 9.7 mttt -72.6 -23.47 60.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.102 0.477 . . . . 0.0 111.027 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.409 ' C ' ' HB2' ' A' ' 17' ' ' LEU . 82.7 m-20 -90.41 -10.28 44.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.057 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.465 ' O ' ' CD2' ' A' ' 18' ' ' LEU . 10.1 t80 -90.85 -68.4 0.79 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.904 179.757 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -91.38 -36.7 13.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.214 -179.489 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.538 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 2.1 ttmt -76.21 -16.58 59.8 Favored 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 120.89 -0.324 . . . . 0.0 111.689 -178.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.409 ' HB2' ' C ' ' A' ' 13' ' ' ASP . 0.5 OUTLIER -81.88 -35.31 29.4 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.137 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.465 ' CD2' ' O ' ' A' ' 14' ' ' PHE . 1.4 mt -61.53 -35.76 78.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.952 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 pp -89.93 11.58 20.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.348 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -114.06 28.69 8.56 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.859 0.362 . . . . 0.0 110.945 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.04 25.03 32.84 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.647 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.441 ' CD2' ' N ' ' A' ' 23' ' ' ASP . 50.9 t80 -115.09 164.22 14.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.775 0.321 . . . . 0.0 110.872 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.441 ' N ' ' CD2' ' A' ' 22' ' ' PHE . 11.9 t70 -98.65 114.99 27.69 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.965 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -66.44 -31.16 71.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.893 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.1 t -56.7 -37.0 70.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.186 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 46.9 t -60.76 -35.71 66.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.204 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.422 ' HG ' ' N ' ' A' ' 28' ' ' ASN . 0.6 OUTLIER -65.48 -33.76 76.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.791 -179.815 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.422 ' N ' ' HG ' ' A' ' 27' ' ' LEU . 8.1 t-20 -65.9 -14.38 61.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.4 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.445 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 3.1 mt-10 -90.14 -33.76 16.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.731 0.301 . . . . 0.0 111.113 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.412 HG11 ' N ' ' A' ' 31' ' ' ILE . 8.0 p -90.82 -43.06 14.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.659 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.412 ' N ' HG11 ' A' ' 30' ' ' VAL . 1.6 mp -62.26 -57.73 10.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.639 -179.248 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.597 ' O ' ' HG2' ' A' ' 36' ' ' LYS . 0.9 OUTLIER -49.55 -21.43 0.98 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -178.855 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.415 ' N ' HD22 ' A' ' 32' ' ' LEU . 89.1 m -90.08 -34.23 16.0 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.676 0.274 . . . . 0.0 111.24 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 83.0 mt -86.43 -30.84 21.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.668 -179.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.405 ' HG3' HG22 ' A' ' 31' ' ' ILE . 2.2 mtt85 -92.38 20.18 6.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.745 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.597 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -113.74 -50.94 2.82 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.796 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.537 ' H ' ' HG3' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 153.93 -20.65 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 122.699 0.4 . . . . 0.0 111.008 179.752 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -64.08 111.44 5.44 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.173 -179.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -78.82 131.48 10.19 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.508 2.139 . . . . 0.0 112.273 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 6.7 mt -59.57 166.95 2.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.926 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -108.73 163.28 17.33 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.09 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.94 -12.75 31.08 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.618 2.212 . . . . 0.0 112.545 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 -82.91 2.95 31.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.374 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -95.23 20.97 8.47 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.708 0.29 . . . . 0.0 111.185 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 61.18 46.72 7.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.897 0.379 . . . . 0.0 111.037 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.4 p-10 -89.52 96.61 10.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.937 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 21.6 p-80 -152.08 -178.07 6.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.931 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -87.02 128.48 35.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.13 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.6 mp -65.62 -175.78 0.3 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.889 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.1 mtmt -117.34 161.19 19.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.898 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.95 -116.52 4.68 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.575 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.14 -14.75 21.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.601 0.239 . . . . 0.0 111.313 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 19.3 m95 -96.24 31.08 2.28 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.061 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.4 OUTLIER -75.53 -51.44 3.2 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.028 179.844 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 50.9 Cg_exo -54.01 -18.69 13.83 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.424 2.082 . . . . 0.0 112.437 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -98.89 175.07 6.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.854 0.359 . . . . 0.0 110.992 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -128.61 132.54 48.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.877 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -95.96 172.76 7.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.072 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 3.2 t -170.18 116.19 0.52 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.638 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.6 m170 -88.57 84.62 6.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.111 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.5 mp -59.05 -27.89 37.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.85 179.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.411 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 7.1 mttp -139.62 168.92 13.47 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.538 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.411 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 17.2 Cg_exo -66.92 -2.93 8.65 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.653 2.235 . . . . 0.0 112.884 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -145.42 29.56 1.15 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.914 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 42.2 t -139.6 151.25 22.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.215 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -157.09 104.09 2.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.595 179.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.1 tp -105.2 116.65 32.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.669 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 34.1 t -85.43 141.86 13.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.222 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.419 ' CD1' HD12 ' A' ' 76' ' ' LEU . 38.3 p90 -147.41 163.6 35.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.963 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.82 157.14 21.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.867 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -111.44 115.02 48.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.099 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.1 163.62 16.13 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.857 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -42.75 -35.61 1.2 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.55 -179.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -156.62 26.53 0.34 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.084 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -149.37 155.88 41.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.768 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.419 HD12 ' CD1' ' A' ' 69' ' ' TYR . 9.8 tp -113.73 132.16 55.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.723 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.2 pp -126.3 130.39 71.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.367 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.422 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 72.7 mt -74.13 142.18 45.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.637 179.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.82 -75.55 0.56 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.169 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -146.95 179.6 7.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.84 0.352 . . . . 0.0 111.287 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -139.6 134.9 32.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.765 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -179.73 176.53 47.62 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.586 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.6 m -112.42 175.32 5.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.829 0.347 . . . . 0.0 110.827 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -59.79 -32.04 70.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.852 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -78.77 -21.32 48.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.045 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.15 -49.69 6.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.833 0.349 . . . . 0.0 110.845 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.4 mt -82.4 -40.94 20.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.977 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.935 -179.964 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.768 0.318 . . . . 0.0 110.895 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.45 152.53 21.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.029 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 7.7 tt -128.54 138.43 52.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.744 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -119.59 179.06 4.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.987 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -147.08 122.74 10.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.818 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.4 mttp -103.17 169.3 8.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.871 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 7.0 tttt -65.83 -43.58 88.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.855 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.5 m -58.76 -29.88 67.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.974 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.419 ' CE1' HD13 ' A' ' 67' ' ' LEU . 38.7 t80 -77.14 -41.56 41.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.949 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -58.82 -45.13 90.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.866 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.476 ' O ' ' N ' ' A' ' 16' ' ' LYS . 2.7 mmmt -73.51 -45.06 56.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.026 0.441 . . . . 0.0 110.717 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.576 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -49.3 -25.76 2.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.982 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.49 ' O ' HD13 ' A' ' 18' ' ' LEU . 75.9 t80 -91.49 -72.47 0.58 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.033 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.516 ' HA ' HD13 ' A' ' 18' ' ' LEU . 9.1 t70 -51.01 -45.3 61.16 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.357 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.476 ' N ' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -72.94 -13.5 61.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.36 -179.853 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.576 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 5.6 mt -90.34 -53.49 4.43 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 121.025 0.44 . . . . 0.0 110.356 179.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.516 HD13 ' HA ' ' A' ' 15' ' ' ASP . 0.5 OUTLIER -52.32 -33.87 44.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.219 -179.855 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.3 pp -90.06 13.94 13.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.237 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -123.79 13.29 9.24 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.556 0.217 . . . . 0.0 111.406 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.41 29.16 5.77 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.787 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -110.73 118.13 35.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.888 0.375 . . . . 0.0 110.779 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -58.51 119.89 7.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.871 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -66.17 -30.3 70.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.952 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 94.1 p -57.23 -27.51 62.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.153 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 31.4 t -71.96 -37.83 62.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.336 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.415 ' HG ' ' N ' ' A' ' 28' ' ' ASN . 1.0 OUTLIER -59.76 -34.94 73.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.02 -179.819 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.415 ' N ' ' HG ' ' A' ' 27' ' ' LEU . 6.0 t-20 -61.25 -18.15 56.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.283 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.413 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 51.1 mt-10 -88.98 -35.76 16.22 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.78 0.324 . . . . 0.0 111.331 -179.759 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 15.0 p -90.69 -31.13 5.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.932 -179.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.5 mp -75.35 -47.98 32.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.658 -179.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.496 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 0.6 OUTLIER -56.34 -22.69 32.48 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.134 -179.539 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.4 m -85.39 -27.39 25.84 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.673 0.273 . . . . 0.0 111.208 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.2 mt -84.64 -33.72 23.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.312 -179.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -96.68 20.35 10.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.303 -179.89 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.534 ' O ' ' HG3' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -119.29 27.08 9.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.409 -179.768 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.534 ' HG3' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 35.6 36.14 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.67 -179.906 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -102.79 132.71 20.96 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.667 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -74.66 138.31 23.75 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.407 2.071 . . . . 0.0 112.524 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 6.0 mt -88.22 134.49 33.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.702 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -61.79 152.94 74.19 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.007 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.64 -8.25 23.18 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.532 2.155 . . . . 0.0 112.682 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.14 6.76 27.76 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.344 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -90.02 9.12 29.21 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.583 0.23 . . . . 0.0 111.316 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 36.2 mm-40 57.77 41.01 25.73 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.939 0.399 . . . . 0.0 111.057 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -87.54 86.56 7.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.984 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -139.84 -172.0 3.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.952 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.58 148.77 44.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.199 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.7 mp -84.74 177.68 7.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.875 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.18 156.76 22.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.89 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.95 -131.46 10.75 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.609 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.42 -13.92 50.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.56 0.219 . . . . 0.0 111.276 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 8.9 m95 -95.49 23.83 5.68 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.661 0.267 . . . . 0.0 111.291 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.463 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.4 OUTLIER -60.67 -49.16 90.95 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.047 179.988 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.463 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 36.9 Cg_exo -57.42 -16.85 24.73 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.449 2.099 . . . . 0.0 112.43 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.424 ' CD2' ' HG ' ' A' ' 79' ' ' LEU . 96.7 m-85 -93.3 176.31 6.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.867 0.365 . . . . 0.0 111.02 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 22.2 ttm180 -132.29 137.88 47.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.899 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -95.91 176.19 6.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.046 -179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 3.0 t -169.06 107.01 0.43 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.888 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 7.0 m170 -92.08 77.4 5.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.847 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.444 ' CD1' ' HB3' ' A' ' 67' ' ' LEU . 4.3 mp -58.28 -28.97 36.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.061 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.3 mtpm? -139.06 169.47 12.38 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.875 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_exo -70.7 -2.47 10.9 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.77 2.313 . . . . 0.0 112.838 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -139.55 27.1 2.29 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.836 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 46.2 t -140.13 149.97 21.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.016 0.436 . . . . 0.0 111.1 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -148.6 91.46 1.89 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.608 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.444 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 2.4 tp -91.42 122.76 34.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.962 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 56.0 t -99.15 133.46 41.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.912 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.424 ' CE1' HD12 ' A' ' 76' ' ' LEU . 23.7 p90 -140.95 172.49 12.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.92 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.7 tp -118.5 136.12 54.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.872 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 8.7 p -80.67 159.29 4.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.172 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.75 156.54 44.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.895 179.381 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -40.9 -32.3 0.22 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.837 -179.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -165.6 33.57 0.05 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.759 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -156.67 163.5 39.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.949 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.424 HD12 ' CE1' ' A' ' 69' ' ' TYR . 11.8 tp -125.9 139.62 53.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.712 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.8 pp -129.46 129.8 67.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.171 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 66.8 mt -73.29 146.22 45.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.882 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.424 ' HG ' ' CD2' ' A' ' 56' ' ' PHE . 0.1 OUTLIER -112.98 -70.75 0.79 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.009 -179.891 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.87 157.48 37.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.041 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -111.49 133.7 53.59 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.032 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -136.99 -167.91 11.24 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.371 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.6 m -151.13 162.23 41.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.844 0.354 . . . . 0.0 110.795 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -55.75 -28.0 53.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.752 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 64.8 m -89.93 -27.43 19.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.826 179.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.06 -70.91 0.47 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.987 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 17.9 mt -68.81 -37.07 78.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.967 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.884 179.968 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.774 0.321 . . . . 0.0 110.845 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.63 150.51 32.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.973 -179.958 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.0 tt -119.33 148.08 43.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.833 179.945 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -135.14 -177.58 4.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.9 -179.96 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.433 ' CD2' ' CD2' ' A' ' 10' ' ' PHE . 17.2 mt -146.73 133.6 20.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.975 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.4 mmmt -104.34 174.76 5.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.969 179.94 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.7 tttm -64.98 -33.11 75.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.951 -179.975 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 m -69.52 -46.62 66.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.972 179.96 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.433 ' CD2' ' CD2' ' A' ' 6' ' ' LEU . 23.5 t80 -59.74 -30.08 68.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.98 -179.994 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.0 mm-40 -60.42 -46.12 91.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.0 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.486 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 0.7 OUTLIER -73.85 -19.85 60.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.047 0.451 . . . . 0.0 111.174 -179.993 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -90.46 -16.96 27.99 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.984 179.708 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.513 ' O ' HD11 ' A' ' 18' ' ' LEU . 20.4 t80 -90.99 -68.54 0.78 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.434 -179.506 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.406 ' HA ' HD23 ' A' ' 18' ' ' LEU . 38.8 t70 -91.01 -40.51 11.61 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -178.903 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.486 ' HB3' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -70.89 -24.8 62.55 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.35 -178.979 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 27.4 tp -72.54 -34.47 67.56 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 179.151 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.524 HD12 ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -57.63 -31.11 65.92 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.733 179.859 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 14.4 mt -89.97 -6.56 55.53 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.442 -179.984 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.68 28.3 3.48 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.732 0.301 . . . . 0.0 111.105 -179.861 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 92.89 23.05 26.43 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.814 179.804 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.524 ' CD1' HD12 ' A' ' 18' ' ' LEU . 11.1 t80 -113.79 135.44 53.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.857 0.361 . . . . 0.0 110.768 179.81 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.414 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 18.6 t0 -93.39 122.1 35.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.923 -179.98 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -58.3 -20.57 43.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.429 179.959 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 t -50.57 -55.42 16.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.732 0.301 . . . . 0.0 111.195 -179.88 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 37.9 t -67.2 -34.87 72.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.079 -179.952 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.4 tp -62.99 -29.93 71.2 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.715 179.949 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -63.5 -22.88 67.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.212 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -87.07 -18.16 31.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.351 -179.896 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 66.3 t -90.26 -69.53 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.003 0.43 . . . . 0.0 111.613 -179.705 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.423 HG12 ' CE1' ' A' ' 14' ' ' PHE . 1.2 mp -48.42 -44.01 13.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.231 -178.975 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.402 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -60.8 -15.94 35.4 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 121.079 -0.248 . . . . 0.0 111.568 -179.418 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 85.7 m -90.08 -36.27 14.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.759 0.314 . . . . 0.0 111.025 179.94 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.9 mt -82.34 -29.61 30.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.331 -179.586 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 22.0 mtt180 -94.62 20.31 8.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.398 -179.76 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.474 ' O ' ' CG ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -126.68 26.76 6.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.068 -179.822 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.474 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 0.6 OUTLIER 47.33 53.67 10.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.178 -179.82 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -128.45 102.78 20.31 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.703 179.944 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -68.09 136.67 38.53 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.396 2.064 . . . . 0.0 112.341 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.42 HD22 ' CD2' ' A' ' 44' ' ' PHE . 1.2 mp -74.1 158.21 34.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.993 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.19 164.28 53.15 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.005 -179.909 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.53 -13.34 38.72 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.61 2.207 . . . . 0.0 112.487 179.941 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -86.89 7.49 27.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.421 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.42 ' CD2' HD22 ' A' ' 40' ' ' LEU . 4.8 m-85 -93.53 14.17 19.61 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.109 179.941 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 58.76 38.69 24.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.91 0.386 . . . . 0.0 111.057 179.979 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.9 p-10 -83.62 79.74 9.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.892 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -137.43 176.11 9.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.94 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.69 152.45 37.51 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.143 -179.905 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 8.1 mt -97.15 -176.67 3.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.785 179.957 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -135.24 155.68 50.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.995 0.426 . . . . 0.0 110.899 -179.979 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.418 ' C ' ' H ' ' A' ' 53' ' ' TRP . . . 60.4 106.35 0.01 OUTLIER Glycine 0 CA--C 1.508 -0.387 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.704 179.951 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.53 -46.77 0.59 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.63 0.252 . . . . 0.0 111.074 179.939 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.418 ' H ' ' C ' ' A' ' 51' ' ' GLY . 62.3 m95 -99.63 33.33 2.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.823 0.344 . . . . 0.0 111.018 -179.881 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.44 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -71.63 -50.83 9.88 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.899 -179.948 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.44 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 14.1 Cg_exo -68.74 -7.08 19.55 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.639 2.226 . . . . 0.0 112.43 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.408 ' CD2' ' HG ' ' A' ' 79' ' ' LEU . 69.5 m-85 -102.2 178.3 4.64 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.949 0.404 . . . . 0.0 111.071 -179.785 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.47 144.64 42.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.726 -179.984 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -107.18 168.57 9.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.998 -179.944 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 15.0 t -168.33 123.8 0.98 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.896 179.878 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 9.1 m170 -93.28 93.17 8.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.97 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.4 mp -60.1 -31.56 48.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.861 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.43 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 6.1 mtpp -145.89 172.5 5.21 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.622 -179.932 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.43 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 17.4 Cg_exo -66.38 -4.29 10.39 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.672 2.248 . . . . 0.0 112.856 -179.888 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -142.02 29.07 1.68 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.861 179.792 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.2 t -149.39 143.29 18.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.257 -180.0 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -159.13 118.71 3.03 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.683 179.961 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.48 136.69 54.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.85 0.357 . . . . 0.0 110.968 -179.934 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 57.1 t -91.53 137.13 22.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.894 -179.958 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -135.49 172.95 12.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.858 179.934 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.406 HD13 ' CD2' ' A' ' 56' ' ' PHE . 5.0 tp -117.23 162.23 18.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.905 -179.971 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.6 t -106.03 113.38 42.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.12 179.967 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -109.28 159.82 16.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.89 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -58.6 106.44 0.4 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.9 179.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.5 t70 57.4 26.59 12.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.101 -179.809 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -157.78 148.7 21.13 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.855 -179.988 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.6 tp -120.72 138.12 54.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.834 179.974 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.2 pp -124.84 135.61 63.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.198 -179.96 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 58.4 mt -80.04 142.78 34.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.735 179.789 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.408 ' HG ' ' CD2' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -103.89 -71.69 0.72 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.06 -179.789 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.91 161.07 40.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.882 0.373 . . . . 0.0 111.349 -179.841 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.417 ' HB2' ' CE1' ' A' ' 10' ' ' PHE . 1.7 tm? -123.73 133.44 53.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.635 179.911 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -155.03 -176.95 27.82 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.572 179.987 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.7 t -121.5 172.31 8.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.803 0.335 . . . . 0.0 110.936 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -60.06 -28.41 67.77 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.873 179.988 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 49.3 p -82.86 -21.62 34.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.157 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.68 -66.81 0.86 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.809 0.338 . . . . 0.0 111.015 -179.827 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.7 mp -57.69 -37.15 72.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.084 -179.818 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.86 -179.934 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 6.6 mt . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.843 0.354 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.89 150.54 45.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.863 179.875 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 7.6 tt -119.51 150.16 40.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.971 179.957 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -136.47 170.38 16.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.918 179.989 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 39.4 mt -131.18 117.76 19.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.798 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -87.61 165.68 15.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.947 179.911 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.0 mttt -66.89 -40.12 87.67 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.83 -179.973 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.9 t -58.96 -35.77 73.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.965 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 39.7 t80 -61.42 -30.16 70.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.008 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -75.95 -33.98 59.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.92 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.434 ' O ' ' CB ' ' A' ' 16' ' ' LYS . 60.6 mttt -89.98 -14.16 34.6 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.199 179.853 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.456 ' O ' ' CB ' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -90.31 -21.18 22.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.971 0.415 . . . . 0.0 110.434 179.394 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.511 ' O ' HD13 ' A' ' 18' ' ' LEU . 40.8 t80 -91.4 -74.65 0.5 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.951 179.461 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.513 ' HA ' HD13 ' A' ' 18' ' ' LEU . 0.2 OUTLIER -51.07 -47.99 61.69 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.781 -179.967 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.434 ' CB ' ' O ' ' A' ' 12' ' ' LYS . 1.6 tppt? -71.87 -13.3 61.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.69 -179.455 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.458 ' HG ' ' CB ' ' A' ' 22' ' ' PHE . 28.3 tp -90.64 -51.31 5.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.933 0.397 . . . . 0.0 110.348 179.837 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.513 HD13 ' HA ' ' A' ' 15' ' ' ASP . 0.4 OUTLIER -55.76 -34.63 65.38 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.344 -179.904 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.0 pp -80.81 -10.7 59.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.224 179.874 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.12 23.14 6.79 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.732 0.301 . . . . 0.0 111.203 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.73 42.36 7.78 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.725 179.806 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.458 ' CB ' ' HG ' ' A' ' 17' ' ' LEU . 89.2 t80 -114.5 122.49 46.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.823 0.344 . . . . 0.0 110.879 179.814 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -61.32 103.39 0.3 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.838 -179.979 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -64.01 -24.42 67.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.128 -179.914 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.2 m -61.68 -47.52 84.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.236 -179.77 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 39.9 t -56.03 -43.89 76.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.313 -179.682 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.418 ' CD2' HD21 ' A' ' 18' ' ' LEU . 0.4 OUTLIER -59.83 -30.4 68.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.825 -179.963 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -53.45 -32.01 48.05 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.677 179.835 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -75.71 -20.24 58.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.865 179.677 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 87.0 t -90.52 -74.0 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.761 -179.695 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.6 mp -44.11 -45.53 2.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.452 -178.985 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.445 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -58.92 -16.69 18.91 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.864 -0.334 . . . . 0.0 111.531 -179.453 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.428 ' N ' HD21 ' A' ' 32' ' ' LEU . 65.2 m -90.0 -27.63 19.63 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 120.79 0.328 . . . . 0.0 110.785 179.689 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 30.1 mt -85.92 -33.42 21.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.241 -179.728 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.0 mtm180 -94.69 20.28 8.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.4 -179.74 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.445 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.1 OUTLIER -122.72 22.3 9.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.374 -179.867 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.434 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 0.6 OUTLIER 45.38 45.83 10.22 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.293 -179.946 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -117.46 127.97 26.32 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.798 -179.992 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.51 154.58 55.31 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.436 2.09 . . . . 0.0 112.257 -179.983 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.5 mp -102.46 146.32 28.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.92 179.972 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -66.79 158.58 79.48 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.922 179.918 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.51 -29.05 53.26 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.51 2.14 . . . . 0.0 112.18 179.949 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.36 -20.42 62.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.062 179.966 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.434 ' CE2' ' HA ' ' A' ' 61' ' ' ILE . 4.0 m-85 -61.3 -23.52 65.76 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.035 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 62.05 42.19 10.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.955 -179.991 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -75.54 84.08 2.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.845 179.932 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -134.02 -168.67 2.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.87 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -84.33 138.29 32.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.251 179.931 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.0 mp -76.75 -174.15 2.91 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.837 179.966 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.4 mttm -125.23 153.71 42.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.879 179.962 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 96.32 -113.71 4.74 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.644 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.1 -19.56 20.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.602 0.239 . . . . 0.0 111.15 -179.871 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 36.3 m95 -96.37 30.64 2.46 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.87 0.367 . . . . 0.0 110.945 -179.963 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.521 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 2.6 mtpt -69.48 -54.77 10.49 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.536 -179.874 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.521 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 21.7 Cg_endo -61.37 -10.42 15.89 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.293 1.995 . . . . 0.0 112.788 -179.799 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.422 ' CD1' HD21 ' A' ' 79' ' ' LEU . 47.4 m-85 -104.75 172.31 6.86 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.874 0.368 . . . . 0.0 110.918 179.818 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.3 ttm180 -120.31 158.29 27.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.783 -179.813 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -123.95 162.96 22.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.036 -179.92 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.1 t -154.97 112.24 3.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.754 179.933 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 9.1 m170 -86.02 71.16 10.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 -179.88 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.434 ' HA ' ' CE2' ' A' ' 44' ' ' PHE . 3.8 mp -59.08 -27.14 35.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.07 179.818 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.425 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 3.3 mttp -148.73 164.77 20.02 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.637 -179.804 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.425 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 42.0 Cg_endo -67.4 -3.22 9.65 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.447 2.098 . . . . 0.0 112.848 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -139.19 26.71 2.39 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.675 179.708 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 52.1 t -143.42 146.16 21.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.264 -179.909 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.7 mt -147.95 96.58 2.67 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.718 179.855 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -84.51 134.87 34.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.01 -179.986 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 94.7 t -106.83 119.83 57.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.399 179.261 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -136.13 178.32 7.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.062 -179.498 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.2 tp -130.29 168.5 16.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.914 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -120.47 110.01 27.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.117 -179.981 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.87 176.48 5.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.778 179.986 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -59.78 103.16 0.19 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.905 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 55.89 24.52 7.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.119 -179.855 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -149.61 153.56 37.26 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.91 -179.957 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.0 tt -123.88 144.14 49.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.684 179.853 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.5 pp -129.33 138.05 55.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.315 -179.788 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 89.6 mt -86.58 131.46 34.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.553 179.625 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.422 HD21 ' CD1' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -91.78 -74.17 0.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.104 -179.607 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.75 177.68 11.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.874 0.369 . . . . 0.0 111.345 -179.845 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -119.2 134.76 55.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.93 -179.885 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -140.61 -173.18 13.3 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.538 179.961 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.9 m -144.58 171.07 14.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.867 0.365 . . . . 0.0 110.99 -179.968 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -59.68 -28.45 67.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.95 179.91 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.2 m -87.83 -26.31 22.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.087 -179.985 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -80.67 -70.21 0.54 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.912 -179.932 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.25 -38.29 75.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.01 -179.908 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.919 179.984 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.5 mt . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.836 0.35 . . . . 0.0 111.015 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.12 150.72 28.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.851 179.927 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 tt -116.06 147.5 41.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.916 179.996 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -133.9 -178.39 5.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.943 179.945 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.3 mt -142.82 112.14 6.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.874 -179.93 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.2 mmtp -85.61 161.63 19.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.88 -179.997 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 17.4 mmtm -62.06 -30.85 71.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.951 179.969 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.0 t -72.15 -33.27 67.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.98 179.929 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -73.97 -31.1 62.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.904 -179.936 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -65.39 -40.72 93.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.929 179.977 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.406 ' O ' ' CB ' ' A' ' 16' ' ' LYS . 17.5 mttt -88.63 -11.17 46.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.317 179.962 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -90.44 -26.21 19.96 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.828 0.347 . . . . 0.0 110.415 179.516 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.436 ' O ' HD11 ' A' ' 18' ' ' LEU . 66.4 t80 -91.09 -70.71 0.67 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.177 179.866 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -62.6 -52.47 63.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.833 -179.197 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.406 ' CB ' ' O ' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -62.41 -17.68 59.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.62 -179.279 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.415 HD22 ' CD2' ' A' ' 22' ' ' PHE . 44.9 tp -90.23 -40.94 11.87 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.075 0.464 . . . . 0.0 110.34 179.566 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.538 ' N ' HD11 ' A' ' 18' ' ' LEU . 0.0 OUTLIER -48.86 -45.26 40.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.192 -179.705 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.1 mt -90.06 0.79 56.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.802 -179.482 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -97.92 30.79 2.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.853 0.359 . . . . 0.0 111.003 -179.984 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 92.38 22.86 28.19 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.685 179.929 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.523 ' CD1' HD12 ' A' ' 18' ' ' LEU . 30.2 t80 -110.08 127.06 54.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.843 0.354 . . . . 0.0 110.704 179.845 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -68.09 110.35 3.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.888 -179.979 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -61.71 -19.46 62.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.222 179.836 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.66 -20.91 66.09 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.273 179.987 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.8 t -82.1 -40.2 17.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.426 -179.752 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 pp -56.6 -36.56 69.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.965 -179.777 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -63.23 -16.2 59.47 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.408 -179.97 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.418 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 57.2 mt-10 -90.12 -35.27 15.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.837 0.351 . . . . 0.0 111.218 -179.716 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.8 p -90.5 -32.2 5.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.367 -0.379 . . . . 0.0 112.002 -179.589 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.7 mp -76.49 -48.86 25.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.578 -179.446 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.418 ' CD2' ' O ' ' A' ' 29' ' ' GLU . 0.7 OUTLIER -56.96 -22.43 37.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.683 0.278 . . . . 0.0 111.189 -179.752 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 93.5 m -82.68 -28.93 30.29 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.878 0.371 . . . . 0.0 110.808 179.66 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 12.6 mt -90.12 -23.04 21.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.731 -179.421 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -104.16 20.24 18.67 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -179.176 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.466 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 7.4 mtmt -118.37 -55.85 2.19 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.211 179.79 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.466 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 10.1 pttm 156.29 -20.54 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.035 179.665 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -61.86 111.27 4.2 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.072 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -68.64 163.86 35.35 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.412 2.075 . . . . 0.0 112.117 179.8 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.2 mt -86.44 123.42 31.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.064 179.977 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -61.6 157.26 48.74 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.947 -179.871 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.77 -30.56 49.89 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.616 2.21 . . . . 0.0 112.294 179.875 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.79 -19.47 59.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.01 179.822 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.427 ' CE2' ' HA ' ' A' ' 61' ' ' ILE . 3.1 m-85 -62.69 -16.52 57.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.217 179.983 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 67.44 52.06 0.82 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.923 0.392 . . . . 0.0 110.952 -179.862 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.6 p-10 -88.28 107.69 18.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.787 179.902 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.96 -168.29 3.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.855 -179.965 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -90.8 126.89 36.15 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.143 179.855 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.5 mp -64.48 169.01 5.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.895 179.93 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.42 167.75 10.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.09 179.948 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.27 -126.3 7.32 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.559 -179.94 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.03 -5.22 55.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.639 0.257 . . . . 0.0 111.37 179.965 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 6.0 m0 -97.65 29.31 3.39 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.89 0.376 . . . . 0.0 110.966 179.949 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.516 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -66.83 -56.2 14.9 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.407 -179.871 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.516 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 19.0 Cg_endo -59.2 -12.65 16.74 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.343 2.029 . . . . 0.0 112.572 -179.994 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -93.71 170.12 9.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.841 0.353 . . . . 0.0 110.865 179.949 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.78 132.95 44.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.793 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -104.76 170.01 8.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.971 -179.961 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 16.3 t -164.94 122.45 1.6 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.764 -179.981 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 10.4 m170 -93.02 84.22 4.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.068 -179.826 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.427 ' HA ' ' CE2' ' A' ' 44' ' ' PHE . 3.6 mp -64.82 -49.58 79.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.041 0.448 . . . . 0.0 110.811 179.714 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.487 ' HB2' ' CG2' ' A' ' 65' ' ' VAL . 0.1 OUTLIER -111.03 174.11 2.52 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.476 -179.851 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.415 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 12.9 Cg_exo -69.1 -5.82 16.74 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.617 2.211 . . . . 0.0 112.78 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -150.19 34.18 0.65 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.782 179.941 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.487 ' CG2' ' HB2' ' A' ' 62' ' ' LYS . 88.5 t -133.7 142.68 40.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.94 -179.835 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -145.97 98.81 3.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.876 179.97 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -97.65 113.39 25.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.552 179.983 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 60.9 t -85.24 138.07 19.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.255 -179.835 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 31.4 p90 -143.8 147.14 33.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.863 179.781 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.28 157.36 17.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.871 -179.892 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.6 t -107.81 109.92 30.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.25 -179.929 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.66 165.97 19.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.623 179.8 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -41.88 -32.73 0.44 Allowed 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.378 -179.811 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -163.43 29.9 0.09 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.805 179.757 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -150.0 162.02 41.19 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.7 -179.864 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.2 tp -117.13 137.23 52.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.93 0.395 . . . . 0.0 110.66 179.706 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.4 pp -128.16 137.75 56.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.245 -179.849 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 80.0 mt -84.24 119.93 25.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.738 179.788 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.444 ' HB3' ' HD3' ' A' ' 80' ' ' ARG . 0.2 OUTLIER -78.32 -68.86 0.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.901 -179.925 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.444 ' HD3' ' HB3' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -163.04 170.26 18.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.917 0.389 . . . . 0.0 111.355 179.826 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -126.91 134.19 50.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.662 179.96 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -160.39 -168.83 22.87 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.554 179.985 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.1 m -123.85 178.12 5.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.914 0.388 . . . . 0.0 110.732 -179.93 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -60.7 -29.3 69.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.001 -179.857 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.1 t -85.62 -30.43 23.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.035 -179.882 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.53 -71.68 0.4 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.898 -179.827 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.4 -33.36 75.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.867 179.999 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.811 -179.96 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.2 mt . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.764 0.316 . . . . 0.0 110.904 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.83 165.61 3.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.818 179.969 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.6 tt -133.95 153.8 51.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.996 -179.919 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -138.19 -178.11 5.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.806 -179.993 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 15.4 mt -146.14 133.37 20.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.976 -179.956 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.82 164.34 11.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.796 179.968 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.4 -31.73 72.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.93 -179.96 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.6 p -70.29 -37.31 74.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.92 179.988 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -59.2 -49.74 76.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.894 -179.948 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -64.03 -44.36 92.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.916 -179.995 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.0 mmtt -74.37 -7.67 53.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.526 179.968 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.28 -31.76 16.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.767 0.317 . . . . 0.0 110.962 -179.913 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.461 ' CD2' HD22 ' A' ' 18' ' ' LEU . 0.1 OUTLIER -90.21 -54.9 3.82 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.344 179.944 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -49.46 -32.37 11.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.769 179.474 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.57 -22.35 26.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.86 179.62 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 mt -83.77 -49.54 8.99 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 120.943 0.401 . . . . 0.0 110.264 179.682 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.461 HD22 ' CD2' ' A' ' 14' ' ' PHE . 4.3 mm? -47.26 -40.51 16.74 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.398 179.957 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.5 mt -89.54 -0.49 57.54 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.899 -179.405 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -98.52 33.49 2.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.804 0.335 . . . . 0.0 110.782 -179.887 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.66 23.53 53.04 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.331 -179.924 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.413 ' CD1' ' O ' ' A' ' 23' ' ' ASP . 26.4 t80 -107.1 115.84 30.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.809 0.338 . . . . 0.0 110.675 -179.868 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.413 ' O ' ' CD1' ' A' ' 22' ' ' PHE . 5.9 t70 -55.1 146.25 18.85 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.193 -179.742 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -96.52 -29.22 14.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.048 -179.988 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.1 m -57.62 -40.61 79.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.112 -179.861 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 12.2 p -74.62 -26.85 20.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.332 -179.999 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.71 -39.98 86.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.829 0.347 . . . . 0.0 110.901 -179.957 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.466 ' O ' ' HB3' ' A' ' 32' ' ' LEU . 32.1 t-20 -50.27 -57.62 7.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.025 -179.759 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -51.77 -19.83 1.85 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.744 179.952 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 76.6 t -88.94 -74.36 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.836 0.351 . . . . 0.0 111.746 -179.452 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.7 mp -50.77 -45.39 27.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.15 -0.477 . . . . 0.0 112.011 -178.982 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.466 ' HB3' ' O ' ' A' ' 28' ' ' ASN . 0.0 OUTLIER -57.05 -34.61 68.41 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 121.001 -0.28 . . . . 0.0 111.061 -179.498 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.444 ' N ' ' CD2' ' A' ' 32' ' ' LEU . 90.2 m -68.68 -27.11 65.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.796 0.331 . . . . 0.0 110.875 179.88 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 46.7 mt -90.06 -25.73 20.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.414 -179.719 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 20.4 mtp180 -104.17 20.12 18.9 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.278 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.507 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -115.62 -55.85 2.4 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.168 179.886 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.507 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 151.15 -20.43 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.996 0.518 . . . . 0.0 110.882 179.74 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.39 120.6 41.44 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.085 -179.638 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -72.49 -179.34 4.0 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.342 2.028 . . . . 0.0 112.135 179.882 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -123.2 129.28 51.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.84 179.958 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.406 ' HB2' ' CE1' ' A' ' 44' ' ' PHE . 1.9 m-20 -57.41 159.26 9.12 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.115 -179.887 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.75 -10.06 27.0 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.552 2.168 . . . . 0.0 112.471 -179.98 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.33 9.47 23.17 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.339 179.857 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.406 ' CE1' ' HB2' ' A' ' 41' ' ' ASP . 4.1 m-85 -89.43 8.42 30.94 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.292 179.864 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.404 ' HB2' ' CD2' ' A' ' 60' ' ' HIS . 1.2 mp0 60.31 40.0 18.2 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.824 0.345 . . . . 0.0 110.9 179.882 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -82.06 73.08 9.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.844 179.963 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -129.49 172.35 11.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.857 179.947 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -81.62 133.7 35.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.071 -179.946 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 15.4 mt -82.37 176.14 9.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.857 -179.993 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.7 mtpt -114.29 175.66 5.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.924 179.968 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.38 -128.78 13.71 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.5 -179.929 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.1 mmtt -67.98 -26.39 65.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.591 0.234 . . . . 0.0 110.889 179.995 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 5.6 m-90 -97.59 39.38 1.21 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.832 0.349 . . . . 0.0 110.887 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.437 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -75.35 -51.04 3.45 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.205 179.971 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.437 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 71.9 Cg_endo -77.73 3.52 6.84 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.32 2.013 . . . . 0.0 112.671 -179.988 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -114.21 169.31 9.12 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.796 0.331 . . . . 0.0 110.89 179.904 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.412 ' HG2' ' CZ ' ' A' ' 69' ' ' TYR . 1.0 OUTLIER -128.58 145.22 51.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.947 -179.987 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -102.75 165.78 10.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.909 179.946 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -162.31 116.72 1.83 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.855 179.938 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.416 ' CD2' ' N ' ' A' ' 60' ' ' HIS . 5.0 m170 -90.68 85.88 6.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.986 179.978 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.3 mp -59.8 -29.17 42.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.021 -179.978 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.403 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 4.7 mtpt -142.61 168.34 13.61 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.77 -179.911 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.403 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 20.3 Cg_exo -65.43 -6.71 14.09 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.643 2.229 . . . . 0.0 112.743 -179.916 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -138.64 25.95 2.57 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.86 179.789 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 67.5 t -140.78 140.83 32.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.218 179.945 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -157.31 114.86 3.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.485 179.974 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.23 139.43 53.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.039 -179.881 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 39.2 t -88.69 147.0 5.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.794 179.841 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.412 ' CZ ' ' HG2' ' A' ' 57' ' ' ARG . 9.0 p90 -148.99 161.08 42.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.115 -179.974 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -116.06 156.69 25.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.828 179.958 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.3 t -107.33 99.75 9.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.184 179.951 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.76 170.72 13.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.781 179.947 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -60.43 104.25 0.31 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.809 179.945 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 57.17 20.98 6.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.139 -179.843 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -149.55 138.51 21.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.639 -179.982 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.37 148.33 24.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.867 179.699 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.9 pp -139.32 130.8 34.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.331 -179.87 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 80.0 mt -74.96 148.21 40.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.511 179.677 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.38 -73.58 0.68 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.273 -179.698 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.02 161.52 42.18 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.989 0.423 . . . . 0.0 111.499 -179.8 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -115.01 131.56 56.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.694 179.881 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -137.17 -177.75 15.32 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.451 179.931 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.7 m -150.72 178.14 9.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.879 0.371 . . . . 0.0 110.893 179.995 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.0 t-80 -64.04 -27.17 68.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.948 -179.998 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.7 m -87.41 -28.26 22.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.945 179.94 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -85.62 -74.82 0.39 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.015 -179.895 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 41.3 mt -62.08 -41.74 98.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.956 -179.909 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.887 179.982 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 40.1 mt . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.845 0.355 . . . . 0.0 110.885 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.34 149.17 22.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.884 179.915 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -115.66 148.15 40.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.956 179.912 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -133.46 176.75 8.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.824 179.948 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 54.1 mt -148.98 112.8 5.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.928 179.933 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.3 mmtt -86.89 176.87 7.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.935 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.06 -33.57 68.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.845 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.4 t -67.23 -35.9 80.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.949 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -72.06 -31.15 65.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.877 179.933 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -68.99 -40.45 78.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.843 179.976 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.402 ' O ' ' CB ' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -85.73 -9.49 57.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.336 -179.999 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.507 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 0.7 OUTLIER -90.36 -27.18 19.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.714 0.292 . . . . 0.0 111.008 179.915 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.474 ' CG ' HD11 ' A' ' 18' ' ' LEU . 7.4 t80 -91.23 -69.52 0.73 Allowed 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.334 179.704 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.514 ' HA ' HD13 ' A' ' 18' ' ' LEU . 21.1 t0 -49.19 -50.08 39.69 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.239 179.719 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.402 ' CB ' ' O ' ' A' ' 12' ' ' LYS . 1.5 tpmp? -68.08 -13.52 62.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.205 -179.982 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.507 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 3.9 mt -90.27 -55.09 3.74 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-O 121.189 0.518 . . . . 0.0 110.013 179.503 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.514 HD13 ' HA ' ' A' ' 15' ' ' ASP . 0.5 OUTLIER -54.57 -25.89 28.99 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.379 179.868 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 74.9 mt -90.08 -35.15 15.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.941 179.954 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -62.56 -23.36 66.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.146 -179.968 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.99 42.62 0.16 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.47 -179.946 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -113.44 123.54 50.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.777 0.323 . . . . 0.0 110.724 179.908 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -56.38 103.27 0.1 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.897 179.944 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -54.93 -28.71 53.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.026 -179.962 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.13 -27.05 52.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.095 -179.959 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 35.2 t -72.51 -35.74 52.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.261 -179.88 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.405 ' HG ' ' N ' ' A' ' 28' ' ' ASN . 1.2 pp -58.54 -36.66 74.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.186 -179.625 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.405 ' N ' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -58.42 -19.63 37.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.319 -179.798 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -90.06 -37.69 14.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.388 -179.624 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.409 HG12 ' CD1' ' A' ' 31' ' ' ILE . 14.8 p -90.31 -44.99 14.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 112.162 0.431 . . . . 0.0 112.162 -179.197 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.409 ' CD1' HG12 ' A' ' 30' ' ' VAL . 1.7 mp -62.25 -51.94 66.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.55 0.214 . . . . 0.0 111.408 -179.506 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.9 -37.24 63.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.716 0.293 . . . . 0.0 111.081 -179.576 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 84.8 m -65.88 -37.65 86.71 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.866 0.365 . . . . 0.0 110.598 179.867 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.2 mt -72.82 -30.01 63.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.841 179.924 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.4 mtp180 -102.95 20.13 18.11 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.997 -179.983 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.441 ' O ' ' CG ' ' A' ' 37' ' ' LYS . 2.5 mmmt -116.85 19.38 14.43 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.369 -179.899 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.441 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 3.9 pttp 45.77 39.2 4.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.263 -179.957 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -108.07 111.91 61.78 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.731 -179.922 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -67.3 136.87 41.67 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.419 2.079 . . . . 0.0 112.257 179.961 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 27.0 mt -79.45 179.8 7.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.877 179.984 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -112.23 155.71 43.12 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.932 -179.988 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -67.17 -10.93 30.32 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 122.629 2.219 . . . . 0.0 112.537 179.92 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.96 7.23 25.14 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.417 179.937 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -93.47 14.95 17.08 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.585 0.231 . . . . 0.0 111.121 179.89 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 59.25 38.17 23.43 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.868 0.366 . . . . 0.0 110.972 179.89 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -93.55 112.72 24.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.927 179.945 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 24.8 p-80 -163.36 -175.74 4.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.899 -179.981 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.38 129.58 35.0 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.113 179.97 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.4 mp -74.39 174.63 8.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.829 -179.929 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -102.63 163.58 12.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.895 -179.915 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.25 -137.51 18.51 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.602 -179.92 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.56 -5.07 48.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.649 0.261 . . . . 0.0 111.45 179.965 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 9.5 m0 -97.05 33.2 1.97 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.791 0.329 . . . . 0.0 111.096 -179.955 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.438 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 7.2 tttt -81.44 -51.05 0.89 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.962 179.957 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.438 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 50.2 Cg_exo -55.46 -18.12 18.59 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.425 2.084 . . . . 0.0 112.367 179.749 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.425 ' CG ' HD22 ' A' ' 79' ' ' LEU . 17.1 m-85 -102.1 177.86 4.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.904 0.383 . . . . 0.0 111.012 -179.985 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.7 tpp180 -135.96 139.63 43.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.936 179.984 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -95.95 158.68 15.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.815 179.955 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 2.6 t -160.94 113.41 1.93 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.866 -179.945 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.408 ' CD2' ' N ' ' A' ' 60' ' ' HIS . 3.5 m-70 -97.2 89.46 4.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.981 179.928 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.4 mp -55.08 -27.49 19.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.013 179.762 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.431 ' HB2' ' CD ' ' A' ' 63' ' ' PRO . 0.0 OUTLIER -154.77 170.96 7.76 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.551 179.971 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.431 ' CD ' ' HB2' ' A' ' 62' ' ' LYS . 17.0 Cg_exo -67.0 -0.06 4.33 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.689 2.259 . . . . 0.0 113.164 -179.702 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -134.86 25.21 3.64 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.664 0.268 . . . . 0.0 111.157 179.89 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 58.4 t -155.63 143.63 12.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.004 0.431 . . . . 0.0 111.309 179.913 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -159.13 100.43 1.54 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.693 179.794 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -105.84 151.51 24.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.893 -179.858 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 59.0 t -100.53 139.95 20.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.13 -179.914 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 16.9 p90 -145.66 158.48 43.84 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.924 179.912 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.7 tp -114.08 157.77 22.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.857 179.866 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -113.75 105.34 18.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.206 -179.919 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 10.6 tptt -76.09 165.73 24.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.666 179.815 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -44.53 -31.87 1.24 Allowed 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.363 -179.942 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -160.4 28.79 0.16 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.787 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -148.55 163.51 36.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.654 179.985 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.0 tp -122.52 130.9 53.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.673 179.658 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.1 pp -122.8 133.35 69.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.349 -179.665 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 85.7 mt -82.25 126.61 32.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.637 179.648 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.425 HD22 ' CG ' ' A' ' 56' ' ' PHE . 0.1 OUTLIER -85.38 -66.21 0.92 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.055 -179.783 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.13 165.71 26.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.989 0.423 . . . . 0.0 111.478 -179.945 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -124.7 135.65 53.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.656 -179.913 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -162.3 -172.19 29.42 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.687 179.932 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.92 -167.97 1.96 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.837 0.351 . . . . 0.0 110.878 -179.915 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -73.54 -27.53 61.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.022 -179.964 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.5 t -86.56 -22.69 26.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.221 -180.0 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -87.28 -69.13 0.7 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.853 0.359 . . . . 0.0 111.041 -179.987 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 25.4 mt -59.83 -40.68 89.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.025 -179.959 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.892 179.971 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 62.1 mt . . . . . 0 N--CA 1.457 -0.107 0 CA-C-O 120.736 0.303 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.69 156.11 17.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.918 179.997 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.2 tt -120.28 143.75 48.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.842 179.939 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -126.7 178.5 5.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.985 -179.929 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 41.0 mt -144.18 123.12 12.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.899 179.965 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.3 mmmt -97.05 174.42 6.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.978 -179.924 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.06 -46.53 80.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.802 179.911 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 t -58.06 -24.11 57.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.934 179.831 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.489 ' HA ' ' OD2' ' A' ' 13' ' ' ASP . 32.9 t80 -84.23 -26.59 28.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.034 179.976 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -69.51 -28.03 65.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.204 -179.782 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.463 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -90.04 -7.47 53.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.781 -179.745 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.489 ' OD2' ' HA ' ' A' ' 10' ' ' PHE . 18.4 p30 -90.6 -15.97 29.57 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.894 0.378 . . . . 0.0 111.57 -179.811 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.542 ' O ' ' CD1' ' A' ' 18' ' ' LEU . 8.8 t80 -90.86 -60.21 1.97 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.228 -178.994 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.443 ' HA ' HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -91.6 -41.0 11.01 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.374 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.463 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 2.0 mptm? -69.99 -40.08 75.53 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -178.839 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.39 -29.39 67.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.929 0.395 . . . . 0.0 110.214 179.698 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.544 HD12 ' CD1' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -62.47 -24.1 67.27 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.116 179.856 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.2 15.11 10.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.393 -179.885 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -123.87 45.0 2.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.818 0.342 . . . . 0.0 110.885 179.873 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 71.21 28.89 69.32 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.328 -179.946 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.544 ' CD1' HD12 ' A' ' 18' ' ' LEU . 8.9 t80 -113.18 140.58 47.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.854 0.359 . . . . 0.0 110.783 -179.93 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.419 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 4.3 t0 -97.49 117.9 32.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.902 179.987 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -59.73 -28.73 67.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.237 -179.923 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 25.1 p -54.96 -23.31 18.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.542 -179.83 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.6 t -87.38 -42.71 15.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.765 0.317 . . . . 0.0 111.384 -179.726 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.455 ' CD1' ' CE2' ' A' ' 14' ' ' PHE . 0.4 OUTLIER -59.25 -32.27 69.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.01 -179.833 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -53.51 -31.2 45.07 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.875 -179.986 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -81.63 -23.35 37.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.824 179.696 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 96.2 t -78.08 -73.1 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.023 -179.973 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.6 mp -47.45 -33.57 3.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.865 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.406 ' CD2' ' N ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -58.86 -55.18 38.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.565 179.72 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.406 ' N ' ' CD2' ' A' ' 32' ' ' LEU . 99.2 m -58.53 -34.76 71.35 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.945 -179.943 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.0 mt -66.75 -46.79 74.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.841 -179.978 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -96.04 20.15 10.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.084 179.994 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.8 mmtt -97.37 12.67 32.33 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.398 -179.905 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.4 mtmt 61.94 27.42 16.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.778 0.323 . . . . 0.0 110.832 179.964 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.25 123.72 29.17 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.863 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -74.31 150.22 41.44 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.361 2.04 . . . . 0.0 112.379 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.8 mt -88.27 128.05 35.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.818 179.996 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.26 158.22 88.07 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.066 -179.953 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.66 -10.33 28.36 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.526 2.15 . . . . 0.0 112.455 179.857 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.1 5.86 27.97 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.316 179.817 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -93.69 17.28 12.12 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-O 120.662 0.267 . . . . 0.0 111.183 179.872 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.41 ' HB2' ' CG ' ' A' ' 60' ' ' HIS . 45.0 mm-40 63.98 30.29 14.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.087 179.882 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -88.68 87.92 7.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.906 -179.962 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 17.8 p-80 -143.45 176.37 9.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.873 179.992 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.26 140.29 46.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.101 -179.959 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.4 mt -89.7 174.17 7.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.946 179.884 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.0 mtpm? -109.34 164.6 12.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.946 179.981 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.76 -140.91 22.18 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.513 179.989 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.2 tmtt? -74.02 -8.53 56.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.598 0.237 . . . . 0.0 111.352 -179.974 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 19.7 m-90 -96.51 26.39 4.45 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.762 0.315 . . . . 0.0 111.197 -179.942 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.461 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.2 OUTLIER -74.54 -49.52 4.92 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.002 179.911 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.461 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 43.6 Cg_exo -56.45 -17.65 22.37 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.4 2.067 . . . . 0.0 112.437 179.779 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -110.27 174.45 5.86 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.004 -179.87 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -131.13 154.52 48.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.813 179.923 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -105.03 170.14 8.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.931 -179.928 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 3.5 t -168.5 116.88 0.7 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.738 179.997 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.422 ' CD2' HD22 ' A' ' 66' ' ' LEU . 11.1 m170 -95.32 89.08 5.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.993 -179.938 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.2 mp -66.25 -29.88 48.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.903 179.778 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.4 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 16.8 mttt -136.68 171.79 8.08 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.78 179.966 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.4 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 14.8 Cg_exo -68.18 -3.12 10.14 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.663 2.242 . . . . 0.0 112.906 -179.984 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -147.23 30.39 0.94 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.785 179.82 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 58.8 t -138.37 144.13 31.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.277 179.88 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.422 HD22 ' CD2' ' A' ' 60' ' ' HIS . 0.6 OUTLIER -149.8 108.44 3.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.771 -179.975 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -108.69 133.54 52.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.001 0.429 . . . . 0.0 110.989 -179.957 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 97.4 t -94.7 140.96 15.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.724 179.751 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -146.06 168.48 20.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.905 179.945 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.64 -178.01 4.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.95 -179.822 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.7 t -128.27 115.81 39.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.075 179.871 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -99.51 -178.42 3.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.862 179.99 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -66.28 103.54 1.03 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.854 -179.898 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 56.82 22.73 7.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.14 179.984 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -155.28 136.34 13.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.819 -179.975 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.5 tp -93.93 154.4 17.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.878 -179.992 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.9 pp -138.27 132.92 42.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.266 -179.94 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.425 HD11 ' CZ ' ' A' ' 10' ' ' PHE . 55.4 mt -81.33 142.06 33.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.566 179.686 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.71 -71.12 0.71 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.279 -179.63 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.36 161.08 39.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.011 0.434 . . . . 0.0 111.498 -179.587 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.451 ' N ' ' OD2' ' A' ' 13' ' ' ASP . 3.2 tm? -112.51 125.33 54.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.566 179.94 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -136.27 -161.91 9.31 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.66 -179.918 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.4 p -150.57 -177.75 6.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.904 0.383 . . . . 0.0 110.846 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -66.77 -27.98 68.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.995 179.991 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -87.36 -24.97 24.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.193 -179.96 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.15 -73.63 0.43 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.897 -179.888 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 23.3 mt -61.32 -41.08 96.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.93 -179.96 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.213 -0.898 . . . . 0.0 110.868 -179.952 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 N--CA 1.458 -0.034 0 CA-C-O 120.915 0.388 . . . . 0.0 110.84 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.79 155.91 12.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.836 179.98 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.79 147.46 46.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.993 -179.936 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -133.33 177.62 7.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.849 179.91 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.8 mp -143.48 132.55 22.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.969 179.968 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 30.1 mmtm -107.39 158.91 16.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.806 180.0 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.3 mttp -61.77 -32.67 72.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.765 179.955 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 88.8 p -63.57 -23.31 67.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.153 179.925 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -78.14 -32.07 50.16 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.085 -179.811 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -70.06 -47.88 60.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.128 -179.905 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.455 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -75.21 -6.49 49.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.556 -179.959 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.53 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -90.83 -22.6 20.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.976 179.937 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.456 ' CE2' HD22 ' A' ' 18' ' ' LEU . 43.6 t80 -90.81 -70.85 0.66 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.552 -179.74 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -49.72 -35.81 23.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.212 -179.871 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 4.5 tppt? -76.57 -20.89 56.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.981 179.88 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.53 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 1.6 mt -89.61 -52.21 5.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.951 0.405 . . . . 0.0 110.151 179.187 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.456 HD22 ' CE2' ' A' ' 14' ' ' PHE . 4.3 mm? -49.2 -32.43 10.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.536 -179.771 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.4 pp -89.65 -8.22 52.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.708 -179.629 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -96.6 40.11 1.14 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.846 0.355 . . . . 0.0 110.846 -179.954 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 70.01 27.6 72.82 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.495 -179.936 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -95.35 128.14 41.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.827 0.346 . . . . 0.0 110.81 -179.95 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.98 119.6 6.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.915 -179.97 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -82.59 -34.84 27.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.157 -179.796 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.68 -22.62 47.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.257 -179.929 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.3 t -82.48 -35.06 12.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.392 -179.871 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -56.98 -36.45 70.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.107 -179.69 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -62.77 -23.36 67.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.269 -179.798 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -80.04 -33.82 38.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.138 -179.814 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.426 HG13 ' CD1' ' A' ' 31' ' ' ILE . 11.7 p -89.96 -43.3 14.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.262 -179.879 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.426 ' CD1' HG13 ' A' ' 30' ' ' VAL . 1.5 mp -64.75 -24.7 36.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.871 179.853 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -70.84 -46.85 61.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.15 -179.844 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.8 m -62.81 -25.98 68.51 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.42 -179.473 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.0 mt -90.04 -35.72 15.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.73 0.3 . . . . 0.0 111.544 -179.478 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.17 20.23 7.14 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.335 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.472 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 3.2 mttm -118.43 -55.96 2.18 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.054 179.724 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.472 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 2.3 pttt 154.65 -20.41 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.0 179.565 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.31 120.72 70.02 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.163 -179.627 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.51 -178.74 4.7 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.476 2.118 . . . . 0.0 112.289 179.832 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 59.3 mt -92.31 108.66 20.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.929 179.843 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -58.74 161.6 8.16 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.98 -179.927 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -67.14 -33.25 31.93 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.461 2.107 . . . . 0.0 112.189 179.915 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -58.9 -21.07 56.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.106 179.854 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.425 ' CE2' ' HA ' ' A' ' 61' ' ' ILE . 3.5 m-85 -57.42 -21.78 38.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.136 179.961 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 64.44 66.57 0.6 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.988 0.423 . . . . 0.0 110.963 179.999 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -93.29 106.17 18.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.861 179.911 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 42.1 m80 -124.2 175.5 7.0 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.929 179.972 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -99.31 114.55 27.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.132 -179.967 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.3 mt -61.56 159.13 13.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.837 179.989 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.66 165.74 11.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.107 -179.928 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.426 ' C ' ' H ' ' A' ' 53' ' ' TRP . . . 58.39 108.21 0.01 OUTLIER Glycine 0 CA--C 1.507 -0.429 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.809 179.754 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.4 mptt 69.14 -46.15 0.56 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.628 0.252 . . . . 0.0 111.161 179.815 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.426 ' H ' ' C ' ' A' ' 51' ' ' GLY . 22.6 m95 -97.03 32.14 2.22 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.994 -179.894 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.419 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.2 OUTLIER -69.3 -51.86 16.47 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.087 179.891 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 98.9 Cg_endo -80.21 46.24 2.19 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.437 2.091 . . . . 0.0 112.522 179.933 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -156.52 175.66 13.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.852 0.358 . . . . 0.0 110.88 179.849 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 14.7 ttm105 -137.79 144.04 41.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.919 -179.942 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -105.35 177.31 4.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.975 -179.895 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -168.26 126.09 1.12 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.68 -179.992 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.442 ' CD2' ' N ' ' A' ' 60' ' ' HIS . 2.6 m-70 -102.19 82.69 2.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.07 -179.734 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.432 ' CD1' ' HB3' ' A' ' 67' ' ' LEU . 4.4 mp -59.99 -26.94 37.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.771 179.662 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.419 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 23.5 mtpp -139.82 169.25 12.51 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.566 179.927 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.419 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 12.2 Cg_exo -70.04 -0.19 6.78 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.802 2.335 . . . . 0.0 112.983 -179.86 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -143.33 27.61 1.55 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.875 179.877 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 38.9 t -139.51 152.06 22.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.938 0.399 . . . . 0.0 111.311 179.992 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -148.17 100.54 3.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.552 179.804 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.432 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 4.2 tp -97.48 131.32 44.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.059 -179.679 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 57.1 t -106.14 136.75 39.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.891 179.793 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.408 ' CE1' HD11 ' A' ' 76' ' ' LEU . 45.3 p90 -153.55 164.04 38.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.136 -179.921 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.4 tp -106.39 174.46 5.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.864 179.916 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.4 t -123.86 123.23 66.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.26 -179.957 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 3.7 tptp -100.15 160.97 13.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.743 179.919 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -44.27 -49.46 9.35 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.54 -179.81 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -137.89 28.3 2.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.919 179.927 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 50.6 mp0 -156.88 170.0 23.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.824 179.96 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.408 HD11 ' CE1' ' A' ' 69' ' ' TYR . 0.7 OUTLIER -129.88 141.15 50.85 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.682 179.803 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.3 pp -128.95 131.55 68.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.396 -179.724 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 72.5 mt -73.43 158.44 34.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.599 179.77 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.84 -78.33 0.58 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.045 -179.885 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.72 167.06 29.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.013 0.435 . . . . 0.0 111.253 -179.909 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -114.19 137.72 51.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.696 179.849 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -141.26 -176.32 15.52 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.675 -179.775 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -140.88 -176.15 4.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.812 0.339 . . . . 0.0 110.895 179.985 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -67.75 -27.78 67.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.167 -179.949 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.2 m -90.02 -27.57 19.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.099 -179.97 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -80.18 -75.11 0.27 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.842 0.353 . . . . 0.0 111.015 -179.798 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 29.6 mt -67.17 -38.43 85.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.023 -179.943 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.192 -0.908 . . . . 0.0 111.027 179.92 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 10.3 mt . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.809 0.337 . . . . 0.0 110.92 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -66.56 160.89 24.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.819 179.987 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.9 tt -128.64 144.96 51.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.905 179.781 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -141.48 163.33 33.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.859 -179.925 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.6 mp -124.63 125.55 44.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.858 179.998 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 58.8 mmtt -92.12 168.86 11.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.942 -179.969 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -60.33 -32.23 71.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.782 -179.97 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.3 m -70.83 -47.49 59.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.821 179.936 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.414 ' CE1' HD12 ' A' ' 67' ' ' LEU . 31.3 t80 -63.86 -30.7 71.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.959 -179.833 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -63.23 -46.16 88.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.996 -179.916 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.477 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 7.4 pttt -87.08 -5.6 58.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.597 -179.955 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.401 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -90.77 -15.74 29.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.082 179.778 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.442 ' O ' ' CD1' ' A' ' 18' ' ' LEU . 21.1 t80 -90.82 -74.33 0.5 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.633 -179.474 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -79.65 -32.93 41.65 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -178.899 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.477 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.4 OUTLIER -75.41 -16.57 60.34 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.213 -179.656 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.401 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 32.7 tp -90.14 -37.41 14.22 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.402 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.535 ' N ' HD13 ' A' ' 18' ' ' LEU . 0.2 OUTLIER -50.9 -42.95 59.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.066 179.962 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.5 pp -89.28 0.72 56.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.691 -179.531 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -98.05 32.07 2.52 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.741 0.305 . . . . 0.0 110.85 -179.965 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.79 22.97 40.54 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.503 -179.843 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.533 ' CD1' HD11 ' A' ' 18' ' ' LEU . 34.2 t80 -106.99 141.71 37.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.803 0.335 . . . . 0.0 110.769 179.834 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.413 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 16.0 t70 -78.89 105.58 10.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.829 179.954 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.3 p30 -64.92 -14.26 59.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.455 -179.954 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.1 t -75.84 -20.99 57.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.606 0.241 . . . . 0.0 111.47 -179.866 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 14.3 p -88.8 -27.14 5.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.71 0.291 . . . . 0.0 111.614 -179.633 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 pp -59.11 -37.92 78.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.84 0.352 . . . . 0.0 110.956 -179.855 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -56.89 -24.96 55.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.192 -179.842 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -78.73 -44.73 22.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.152 -179.964 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.5 p -80.58 -48.96 19.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.313 -179.857 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.5 mp -54.0 -34.56 26.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 121.08 0.467 . . . . 0.0 110.228 179.45 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.491 ' HG ' ' HG2' ' A' ' 36' ' ' LYS . 0.9 OUTLIER -52.08 -61.34 2.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.317 179.471 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 39.1 m -54.23 -26.81 30.64 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.564 -179.867 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 32.8 mt -70.44 -49.51 47.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.758 0.313 . . . . 0.0 111.149 -179.766 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.1 mtm180 -77.35 -55.89 5.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.99 0.424 . . . . 0.0 110.806 -179.802 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.553 ' O ' ' CG ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -64.12 -16.7 62.38 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.599 -179.967 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.553 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 0.2 OUTLIER 53.35 73.06 0.39 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.332 179.807 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.492 ' HB2' ' HD2' ' A' ' 36' ' ' LYS . 20.4 tt0 -84.11 139.09 39.42 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.138 178.781 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -58.56 105.0 0.2 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.451 2.101 . . . . 0.0 112.034 179.894 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 50.1 mt -62.48 178.78 0.38 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.013 -179.777 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -140.14 163.52 43.52 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.779 -179.985 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -64.24 -27.91 64.19 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.602 2.202 . . . . 0.0 112.291 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.25 -17.92 64.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.247 179.942 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.416 ' CE2' ' HA ' ' A' ' 61' ' ' ILE . 3.6 m-85 -69.49 -10.7 59.17 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.48 -179.988 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 61.89 36.89 15.63 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.893 0.378 . . . . 0.0 110.902 -179.959 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.2 p-10 -75.77 84.42 2.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.879 179.789 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 -140.48 -177.61 5.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.061 -179.921 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.9 157.23 33.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.162 -179.945 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 53.9 mt -105.3 -178.35 3.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.913 180.0 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -118.08 175.17 5.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.91 -179.879 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 71.81 -138.19 26.73 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.546 -179.954 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.18 -28.19 69.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.694 0.283 . . . . 0.0 111.0 179.98 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 8.1 m95 -97.32 39.26 1.2 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.726 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.439 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 3.1 tmtp? -69.51 -51.38 16.65 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.314 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.439 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 81.9 Cg_endo -78.67 6.6 4.75 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.449 2.1 . . . . 0.0 112.878 -179.787 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -105.39 173.38 6.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.842 0.354 . . . . 0.0 110.87 179.93 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 23.1 ttm180 -131.74 142.9 49.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.979 -179.967 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -110.75 171.67 7.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.985 -179.914 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 8.3 t -160.78 118.47 2.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.719 179.882 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.409 ' CD2' ' N ' ' A' ' 60' ' ' HIS . 3.8 m-70 -94.4 78.7 3.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.977 -179.858 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.458 ' CD1' ' HB3' ' A' ' 67' ' ' LEU . 3.7 mp -57.06 -27.12 26.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.072 179.76 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.5 mtmm -139.37 169.26 12.71 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.708 179.991 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -69.19 -3.32 11.4 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.78 2.32 . . . . 0.0 112.875 -179.834 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -141.29 26.02 2.02 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.922 179.881 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 56.9 t -136.64 147.11 27.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.173 179.97 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.4 mt -144.31 97.98 3.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.647 179.846 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.458 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 4.2 tp -94.15 127.81 40.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.979 -179.865 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 46.6 t -105.08 136.35 39.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.727 179.769 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -147.89 153.67 39.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.054 179.964 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 3.6 tp -99.18 173.13 6.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.893 -179.995 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -123.68 102.94 12.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.181 -179.966 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 13.5 tptp -73.48 162.32 29.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.758 179.962 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -44.95 -43.33 8.92 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.376 -179.86 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -145.4 29.72 1.14 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.819 179.902 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.3 mp0 -157.39 167.99 28.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.802 -179.885 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.8 tp -120.19 139.13 53.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.797 179.902 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.3 pp -128.83 131.6 68.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.339 -179.806 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 71.9 mt -73.68 137.14 43.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.704 179.742 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.09 -72.01 0.63 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.021 -179.767 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -161.16 170.48 20.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.849 0.357 . . . . 0.0 111.32 -179.949 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -122.77 125.33 45.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.93 -179.943 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -135.43 -162.11 9.56 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.464 179.93 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -148.08 155.26 41.27 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.125 0.488 . . . . 0.0 110.909 -179.994 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -49.07 -28.14 3.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.359 -179.886 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 12.1 t -90.09 -22.13 21.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.152 179.823 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -82.71 -73.56 0.39 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.263 -179.83 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.1 mp -51.36 -33.8 31.22 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.289 -179.724 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.27 -0.871 . . . . 0.0 110.873 -179.994 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.4 pp . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.765 0.317 . . . . 0.0 110.873 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.31 150.89 24.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.913 -179.974 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.3 tp -125.16 138.33 54.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.8 179.923 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -118.58 169.58 9.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.835 -179.954 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 33.3 mt -132.21 112.68 12.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.881 -179.961 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.31 161.68 18.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.908 -179.989 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.7 tptt -61.38 -34.46 75.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.825 -179.985 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 39.3 m -69.69 -32.6 71.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.777 179.958 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -73.52 -38.48 65.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.856 -179.965 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -63.34 -37.58 87.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.802 -179.993 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.557 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 1.8 mttp -83.9 -25.56 30.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.234 0.54 . . . . 0.0 111.055 -179.999 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.445 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 1.2 m-20 -90.9 -9.42 46.31 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.067 179.805 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.461 ' O ' ' CD2' ' A' ' 18' ' ' LEU . 47.5 t80 -91.26 -68.02 0.82 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.14 -179.604 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -91.05 -34.59 15.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.806 -179.331 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.557 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -78.68 -15.21 58.75 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.167 -179.48 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.445 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 31.6 tp -80.55 -35.18 34.74 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.957 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.461 ' CD2' ' O ' ' A' ' 14' ' ' PHE . 1.0 OUTLIER -64.01 -53.37 51.1 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.914 179.71 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.3 mt -60.08 -36.96 78.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.928 179.984 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -24.9 61.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.948 179.901 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.97 37.88 0.24 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.639 179.915 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -121.63 163.59 18.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.802 0.334 . . . . 0.0 110.866 -179.987 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -76.13 125.45 29.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.101 -179.854 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.436 ' CB ' HD13 ' A' ' 18' ' ' LEU . 7.6 p-10 -93.26 -15.82 25.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.191 179.741 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.1 m -78.83 -34.69 45.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.787 0.327 . . . . 0.0 111.047 -179.678 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 11.7 p -66.81 -27.38 39.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.389 -179.87 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.433 HD11 ' CZ ' ' A' ' 14' ' ' PHE . 1.3 pp -64.78 -37.97 89.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.106 -179.803 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -61.52 -26.57 68.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.061 -179.988 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.412 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 2.2 mm-40 -74.81 -33.99 62.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.132 -179.869 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.7 p -90.65 -41.08 13.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.923 -179.645 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.5 mp -64.12 -54.91 25.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.718 -179.301 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.579 ' O ' ' HG2' ' A' ' 36' ' ' LYS . 0.8 OUTLIER -50.38 -22.53 1.89 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 -179.073 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 38.9 m -90.29 -42.57 10.9 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 120.659 0.266 . . . . 0.0 111.545 -179.725 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 21.9 mt -80.46 -31.72 37.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.952 -179.023 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.9 mtp-105 -91.38 20.39 5.28 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -179.238 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.579 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 0.6 OUTLIER -115.51 -45.67 2.9 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.11 -0.236 . . . . 0.0 111.635 -179.969 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.511 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 1.0 OUTLIER 150.99 -20.59 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 122.883 0.473 . . . . 0.0 111.082 179.55 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.15 112.11 10.67 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.129 -179.64 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.49 152.88 34.44 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.452 2.101 . . . . 0.0 112.177 179.807 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mt -76.68 115.76 16.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.826 -179.993 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.62 164.47 3.99 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.033 -179.864 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.62 -13.17 32.28 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.574 2.183 . . . . 0.0 112.604 179.943 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -83.57 3.61 31.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.407 -179.947 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -95.48 20.16 9.91 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.693 0.282 . . . . 0.0 111.181 179.999 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 58.0 mm-40 58.83 34.24 23.57 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.896 179.927 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.0 p-10 -82.9 114.88 21.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.892 -179.975 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -168.72 178.03 4.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.959 179.991 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.42 148.02 43.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.117 179.981 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 90.7 mt -102.4 -177.11 3.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.834 179.955 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.77 176.33 5.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.867 -179.915 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 67.93 -136.35 30.94 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.577 179.965 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.44 -25.84 68.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.718 0.295 . . . . 0.0 111.094 -179.869 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.41 ' CD1' HG23 ' A' ' 68' ' ' VAL . 18.5 m-90 -96.65 38.77 1.19 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.912 0.387 . . . . 0.0 110.984 -179.956 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.419 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.1 OUTLIER -73.13 -52.21 5.59 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.011 179.947 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 88.4 Cg_endo -83.2 13.89 2.52 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.646 2.231 . . . . 0.0 112.803 179.973 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.409 ' CD2' ' HG ' ' A' ' 79' ' ' LEU . 96.1 m-85 -114.14 179.18 4.03 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.863 0.363 . . . . 0.0 110.999 -179.921 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.14 149.8 52.43 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.886 -179.985 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -129.91 169.87 14.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.923 -179.963 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 37.5 t -165.04 129.21 2.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.931 -179.951 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.406 ' CD2' ' HB3' ' A' ' 66' ' ' LEU . 23.5 m170 -91.84 83.24 5.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.848 179.837 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.5 mp -56.91 -50.93 73.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.122 -179.966 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.426 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 0.0 OUTLIER -114.82 172.41 3.64 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.483 179.965 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.426 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 16.7 Cg_exo -67.17 -4.28 11.34 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.554 2.169 . . . . 0.0 112.851 -179.874 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -146.81 29.09 1.02 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.874 179.933 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 52.8 t -136.47 145.01 31.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.988 0.423 . . . . 0.0 111.383 179.934 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.406 ' HB3' ' CD2' ' A' ' 60' ' ' HIS . 0.0 OUTLIER -159.13 111.22 2.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.595 179.745 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -111.68 139.03 47.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.875 0.369 . . . . 0.0 111.103 -179.745 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.41 HG23 ' CD1' ' A' ' 53' ' ' TRP . 40.9 t -88.94 139.36 17.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.801 179.84 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.403 ' CD1' ' N ' ' A' ' 69' ' ' TYR . 2.3 p90 -153.84 175.58 13.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.037 -179.952 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.5 tp -130.16 150.13 51.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.888 179.979 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.6 t -106.97 111.43 35.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.109 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.68 168.72 9.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.89 179.963 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.21 108.78 1.14 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.93 -179.922 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.1 t0 57.98 24.2 10.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.069 179.885 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -160.02 141.21 12.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.817 179.989 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -119.93 148.16 43.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.896 -179.972 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.1 pp -131.49 134.32 60.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.26 -179.913 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 62.7 mt -84.93 135.39 34.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.671 179.781 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.409 ' HG ' ' CD2' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -93.73 -61.43 1.55 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.045 -179.927 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.4 175.05 4.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.973 0.416 . . . . 0.0 111.297 179.955 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -116.13 142.36 46.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.793 -179.971 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -148.5 -178.02 23.26 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.507 179.966 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 58.7 m -138.45 177.05 8.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.836 0.351 . . . . 0.0 110.907 179.944 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 8.4 t-80 -64.24 -29.99 71.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.943 -179.969 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.9 m -88.49 -29.95 19.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.895 -179.96 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.27 -68.13 0.55 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.886 -179.949 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 25.3 mt -69.7 -32.68 71.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.931 -179.979 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.938 179.983 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 8.0 mt . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.889 0.376 . . . . 0.0 110.927 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.67 152.69 40.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.957 -179.966 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 tp -120.75 145.27 47.69 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.874 179.931 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -129.88 171.89 12.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.752 179.957 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.6 mp -140.79 119.97 12.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.829 179.997 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -93.58 -176.56 4.12 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.917 179.973 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.7 mmtt -74.18 -31.36 62.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.863 -179.972 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.57 -39.76 73.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.99 -179.96 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.413 ' CE2' HD13 ' A' ' 78' ' ' LEU . 60.3 t80 -71.95 -33.24 68.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.885 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -59.42 -47.09 86.78 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.989 179.964 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.516 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 0.9 OUTLIER -80.34 -13.45 59.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.12 179.892 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -90.72 -11.88 38.31 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.037 179.715 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.535 ' O ' HD11 ' A' ' 18' ' ' LEU . 76.6 t80 -90.69 -65.47 1.01 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.214 -179.612 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.433 ' HA ' HD21 ' A' ' 18' ' ' LEU . 1.8 t70 -91.36 -36.34 13.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.95 -179.324 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.516 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 2.0 mptt -72.37 -36.54 68.75 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.125 -179.046 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.8 tt -61.06 -32.07 71.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.996 0.427 . . . . 0.0 109.908 179.15 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.555 HD12 ' CD1' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -62.51 -23.49 66.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.146 179.89 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -90.06 15.05 10.84 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.446 -179.995 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -127.6 47.91 2.32 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.823 0.344 . . . . 0.0 110.844 -179.979 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.27 30.05 65.5 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.482 -179.923 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.555 ' CD1' HD12 ' A' ' 18' ' ' LEU . 8.6 t80 -120.73 124.55 45.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.784 0.326 . . . . 0.0 110.765 -179.921 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.435 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 25.5 t0 -79.53 140.47 37.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.204 -179.744 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -93.68 16.35 14.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.388 -179.977 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.5 t -90.06 -33.51 16.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.76 0.314 . . . . 0.0 111.348 -179.741 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.3 t -84.14 -38.14 13.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.573 -179.623 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.411 HD11 ' CE1' ' A' ' 14' ' ' PHE . 0.4 OUTLIER -59.86 -36.6 77.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.16 -179.667 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -52.23 -46.07 65.57 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.076 -179.927 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.407 ' HA ' HD13 ' A' ' 32' ' ' LEU . 5.3 mt-10 -64.94 -16.65 63.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.115 179.794 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 95.2 t -90.36 -74.37 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.034 0.445 . . . . 0.0 111.658 -179.541 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.7 mp -45.72 -44.03 4.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.874 -0.603 . . . . 0.0 112.263 -179.005 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.43 HD11 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -58.56 -19.65 39.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.72 0.295 . . . . 0.0 111.512 -179.431 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.43 ' N ' HD11 ' A' ' 32' ' ' LEU . 99.1 m -84.84 -28.74 25.85 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.83 0.348 . . . . 0.0 111.092 179.996 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 73.2 mt -89.9 -34.16 16.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.597 -179.349 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.5 mtp-105 -93.31 20.31 7.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.852 -179.346 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.45 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 10.3 mttm -110.04 -55.5 2.44 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 121.159 -0.216 . . . . 0.0 110.98 179.719 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.45 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 159.72 -20.53 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.27 179.613 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -83.38 118.33 71.25 Favored Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 116.713 -0.222 . . . . 0.0 111.083 -179.71 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -75.99 -179.39 5.16 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.462 2.108 . . . . 0.0 112.295 179.776 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.7 mt -98.89 157.35 16.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.779 179.968 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -96.56 157.75 34.84 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.024 -179.921 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.29 -3.28 13.68 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.632 2.221 . . . . 0.0 112.817 -179.982 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -92.6 17.71 9.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.694 0.283 . . . . 0.0 111.206 179.858 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -113.46 21.52 15.07 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.744 0.307 . . . . 0.0 110.985 179.901 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 62.79 43.92 6.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.828 179.986 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.7 p-10 -88.75 66.21 7.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.853 179.946 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -120.28 178.3 4.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.882 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.77 163.06 28.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.087 -179.991 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.4 mt -106.7 176.76 5.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.886 179.961 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.3 mmtt -116.67 157.07 26.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.041 179.989 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 82.68 -140.22 20.09 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.543 179.978 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm -58.47 -22.92 56.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.737 0.304 . . . . 0.0 111.219 179.999 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 5.0 m95 -96.17 38.48 1.19 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.928 179.953 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.415 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -75.4 -52.19 3.06 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.116 -179.922 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.415 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 90.1 Cg_endo -79.75 47.06 2.4 Favored 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 122.43 2.087 . . . . 0.0 112.347 -179.933 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.456 ' CD1' ' CD2' ' A' ' 79' ' ' LEU . 77.9 m-85 -154.57 178.37 10.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.856 179.878 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -137.17 134.76 36.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.004 -179.981 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -98.8 171.85 7.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.79 179.891 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 14.8 t -168.36 116.66 0.71 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.901 179.985 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.421 ' CD2' HD21 ' A' ' 66' ' ' LEU . 11.3 m170 -93.31 79.04 4.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.915 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.412 ' CD1' ' HB3' ' A' ' 67' ' ' LEU . 2.5 mp -55.19 -26.87 19.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.193 179.843 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.431 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 2.7 mtpp -137.72 166.93 22.65 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.767 -179.751 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.431 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 48.2 Cg_endo -68.58 -2.57 9.51 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.351 2.034 . . . . 0.0 112.789 179.929 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -143.47 27.4 1.54 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.662 179.62 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 60.9 t -136.9 146.38 28.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.208 -179.956 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.421 HD21 ' CD2' ' A' ' 60' ' ' HIS . 5.8 mt -144.24 102.85 3.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.525 179.421 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.412 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 5.2 tp -102.63 131.42 49.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.141 -179.651 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 46.9 t -104.71 138.17 30.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.841 179.843 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 52.5 p90 -157.35 161.59 39.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.063 179.993 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.2 tp -109.36 -176.31 2.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.856 180.0 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.4 t -127.27 104.82 12.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.137 -179.99 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.62 172.61 8.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.871 179.923 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -57.99 102.55 0.11 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.906 179.893 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 58.17 24.75 11.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.961 -179.899 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -151.53 162.49 40.88 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.803 180.0 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.1 tp -123.41 147.66 46.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.832 -179.935 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.4 pp -131.95 128.92 60.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.154 -179.885 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.413 HD13 ' CE2' ' A' ' 10' ' ' PHE . 70.1 mt -73.83 155.4 38.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.684 179.744 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.456 ' CD2' ' CD1' ' A' ' 56' ' ' PHE . 0.3 OUTLIER -117.21 -68.16 0.94 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.94 -179.909 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.81 166.75 29.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.09 179.966 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -121.27 137.85 54.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.824 -179.952 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -154.83 -164.67 13.18 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.638 -179.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.9 p -142.57 176.67 8.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.892 0.377 . . . . 0.0 110.875 179.997 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 26.7 t-80 -59.27 -27.5 65.87 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.049 -179.904 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.6 m -78.85 -28.89 44.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.087 -179.878 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -84.24 -72.98 0.44 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.023 -179.963 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.6 mp -60.72 -39.93 90.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.021 -179.964 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.9 -179.961 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 tpt . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.886 0.374 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.2 pp -57.07 165.94 1.18 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.073 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.413 ' HD2' ' N ' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -82.36 153.99 25.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.916 -179.875 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.413 ' N ' ' HD2' ' A' ' 3' ' ' LYS . 3.1 tp -121.98 146.3 47.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.842 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -136.03 173.68 11.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.861 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.3 mp -144.56 138.02 27.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.981 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.3 mmtp -106.03 171.04 7.56 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.844 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 41.0 tttt -59.23 -30.08 67.99 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.99 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.1 t -70.42 -55.89 7.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.958 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.416 ' CE2' HD13 ' A' ' 78' ' ' LEU . 49.8 t80 -59.08 -33.8 71.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.973 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -60.56 -42.05 95.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.938 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.548 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 3.7 mtpt -89.97 -16.42 29.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.023 0.44 . . . . 0.0 111.464 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -90.75 -11.48 39.41 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.293 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.439 ' CE2' HG12 ' A' ' 31' ' ' ILE . 13.9 t80 -90.34 -69.88 0.7 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.806 0.336 . . . . 0.0 111.349 -179.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -90.76 -29.6 17.53 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -178.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.548 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.6 OUTLIER -79.0 -17.76 54.81 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.374 -179.284 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 38.2 tp -87.18 -34.5 19.0 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.552 HD12 ' CD1' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -51.78 -49.43 62.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.851 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 pp -84.28 2.48 39.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.708 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.75 32.02 2.74 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.938 0.399 . . . . 0.0 110.781 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.86 22.99 43.59 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.524 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.552 ' CD1' HD12 ' A' ' 18' ' ' LEU . 35.9 t80 -103.77 139.28 39.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.832 0.349 . . . . 0.0 110.709 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -70.48 97.79 1.35 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.823 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -68.56 -12.71 61.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.486 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.2 p -73.96 -24.78 59.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.684 -0.234 . . . . 0.0 111.358 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 11.4 p -86.06 -26.2 6.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.465 -179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.33 -37.24 86.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.833 0.349 . . . . 0.0 110.899 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -55.04 -22.19 14.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.315 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -85.94 -46.8 10.22 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.78 0.324 . . . . 0.0 111.362 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.416 HG12 ' CD1' ' A' ' 31' ' ' ILE . 9.5 p -75.04 -46.35 40.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.182 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.439 HG12 ' CE2' ' A' ' 14' ' ' PHE . 1.5 mp -66.19 -15.87 19.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.795 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.4 -27.87 38.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.257 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 58.0 m -87.34 -28.02 22.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.74 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 65.7 mt -90.2 -33.05 16.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.671 -179.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.8 mtp-105 -93.29 20.21 7.31 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.457 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -116.12 -55.94 2.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.583 0.23 . . . . 0.0 111.071 179.673 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.457 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.1 OUTLIER 158.27 -20.48 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.14 179.612 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.87 111.68 9.11 Favored Pre-proline 0 CA--C 1.53 0.182 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.067 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.69 156.8 53.07 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.428 2.085 . . . . 0.0 112.181 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 67.2 mt -65.66 141.8 58.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.96 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -90.15 155.92 46.67 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.04 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.02 -9.06 24.04 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.636 2.224 . . . . 0.0 112.576 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.66 3.68 31.89 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.473 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -94.41 17.99 12.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.611 0.243 . . . . 0.0 111.255 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 54.97 37.36 28.72 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.784 0.326 . . . . 0.0 110.998 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -77.35 121.44 23.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.057 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -172.95 -170.04 0.62 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.886 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.19 134.24 37.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.048 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mp -76.68 177.79 7.26 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.936 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.5 mtmm -113.89 152.65 30.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.891 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.36 -134.92 12.23 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.554 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.99 -13.0 60.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.654 0.264 . . . . 0.0 111.382 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 13.2 m95 -96.56 39.06 1.17 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.796 0.331 . . . . 0.0 110.875 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.444 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 6.9 tttm -69.25 -51.02 18.42 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.47 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.444 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 74.6 Cg_endo -78.36 47.88 2.54 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.305 2.003 . . . . 0.0 112.654 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.431 ' CE2' ' HG2' ' A' ' 55' ' ' PRO . 70.2 m-85 -154.24 170.96 20.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.808 0.337 . . . . 0.0 110.879 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.2 ttm105 -130.46 134.79 47.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.052 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -108.04 162.6 13.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.952 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 15.0 t -171.09 114.22 0.41 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.771 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.452 ' O ' ' CG ' ' A' ' 60' ' ' HIS . 16.9 p80 -90.18 85.11 6.17 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.077 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.422 ' CD1' ' HB3' ' A' ' 67' ' ' LEU . 3.8 mp -53.86 -26.85 14.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.968 179.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.524 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 18.3 mmmt -135.57 161.72 61.38 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.443 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.524 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 37.8 Cg_endo -66.16 -2.3 6.72 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.265 1.976 . . . . 0.0 112.89 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -137.99 23.7 2.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.794 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.3 t -135.71 149.15 27.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.141 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.1 mt -147.22 85.17 1.59 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.621 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.422 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 4.9 tp -86.59 127.87 34.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.124 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 52.0 t -102.4 138.08 28.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.011 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -151.88 170.74 19.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.954 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.8 tp -122.82 151.04 42.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.954 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 28.2 t -102.86 109.6 27.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.125 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.88 173.7 6.19 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.77 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -59.95 103.96 0.26 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.941 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 54.16 24.65 5.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.15 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -150.48 139.58 21.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.875 0.369 . . . . 0.0 110.955 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.2 tp -111.16 150.04 30.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.818 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.2 pp -135.88 130.34 48.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.44 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.416 HD13 ' CE2' ' A' ' 10' ' ' PHE . 80.6 mt -81.24 127.85 33.15 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.624 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.418 HD21 ' CD1' ' A' ' 56' ' ' PHE . 0.0 OUTLIER -88.34 -73.3 0.5 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.055 -179.77 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.92 174.27 15.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.987 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -127.35 139.36 52.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.856 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -151.55 -176.69 24.59 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.453 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 70.2 m -132.85 167.59 19.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.854 0.359 . . . . 0.0 110.753 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -56.76 -31.16 64.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.923 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.5 m -90.33 -22.7 21.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.325 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.58 -67.54 0.78 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.367 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 25.8 mt -51.33 -26.02 6.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.363 -179.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.885 179.989 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.673 0.273 . . . . 0.0 111.112 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.1 mp -78.2 174.5 11.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.85 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.43 160.24 7.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.889 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -125.21 155.86 39.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.043 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -149.61 -178.08 6.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.944 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 21.7 mt -140.23 141.02 35.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.847 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.4 mmtm -115.17 171.9 7.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.928 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.3 mtmm -70.19 -33.15 71.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.927 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.48 -34.38 78.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.827 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -66.51 -29.96 70.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.874 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -64.31 -48.61 74.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.6 mtpt -69.92 -24.46 63.38 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.042 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.498 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 7.1 m-20 -90.07 -22.98 21.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.02 0.438 . . . . 0.0 111.049 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.604 ' O ' HD22 ' A' ' 18' ' ' LEU . 73.4 t80 -90.9 -39.21 12.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.55 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -93.05 -58.06 2.44 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.105 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -47.21 68.58 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.498 ' HB2' ' HA ' ' A' ' 13' ' ' ASP . 3.0 tt -48.17 -39.48 21.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.235 0.54 . . . . 0.0 110.899 -179.136 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.604 HD22 ' O ' ' A' ' 14' ' ' PHE . 2.3 mm? -62.64 -32.43 73.48 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.904 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 21.0 mt -90.07 12.73 16.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.301 179.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -113.86 29.55 7.92 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.874 0.369 . . . . 0.0 110.86 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.23 22.88 46.58 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.796 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.466 ' CG ' ' CD2' ' A' ' 17' ' ' LEU . 83.4 t80 -113.34 122.93 48.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.923 0.392 . . . . 0.0 110.817 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.417 ' O ' ' CD2' ' A' ' 22' ' ' PHE . 3.4 t0 -58.37 159.66 5.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.867 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -108.69 -29.09 8.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.073 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.3 t -55.5 -23.57 26.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.169 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 20.6 t -79.46 -46.72 22.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.282 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.82 -28.57 66.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.94 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -68.23 -15.77 63.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.228 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -90.14 -37.1 14.43 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.344 -179.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.5 p -82.49 -34.26 11.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.819 0.342 . . . . 0.0 111.155 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.6 mp -76.47 -23.31 15.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.789 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.5 -24.77 59.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.076 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 89.4 m -90.1 -22.2 21.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.707 -179.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 12.5 mt -90.45 -42.42 10.88 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 -179.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 54.9 mtt180 -77.75 -40.27 41.56 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.467 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.2 OUTLIER -53.47 -55.78 22.39 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 121.197 -0.201 . . . . 0.0 111.485 -179.162 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.467 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 157.45 -20.41 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.087 179.736 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.37 123.03 27.45 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.159 -179.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.35 162.95 35.45 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.45 2.1 . . . . 0.0 112.264 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 83.6 mt -94.43 103.07 15.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.731 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -57.12 153.23 25.74 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.003 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -69.22 -10.35 28.75 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.504 2.136 . . . . 0.0 112.544 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.54 5.84 29.73 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.34 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -84.25 2.91 37.8 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.724 -0.216 . . . . 0.0 111.312 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 61.93 40.15 12.79 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.88 0.372 . . . . 0.0 111.033 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -78.71 87.21 4.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.767 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -120.53 176.06 5.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.038 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.1 175.26 0.54 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.11 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -113.7 -175.74 2.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.775 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.5 mmtm -135.29 157.61 46.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.879 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.06 -116.61 4.71 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.578 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.62 -24.79 26.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.784 0.326 . . . . 0.0 110.997 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 10.7 m95 -97.43 33.18 2.06 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.879 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.459 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 12.1 tttm -57.73 -50.19 89.49 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.405 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.459 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 72.3 Cg_endo -77.3 4.39 5.92 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.323 2.015 . . . . 0.0 113.009 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -106.75 174.84 5.71 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.753 0.311 . . . . 0.0 110.926 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.1 ttm180 -126.37 150.66 48.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.907 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -111.51 172.16 7.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.893 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -156.86 116.71 3.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.788 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -95.76 80.36 3.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.054 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.7 mp -67.23 -38.98 82.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.04 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.444 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 5.0 mttm -122.27 168.3 11.97 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.748 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.444 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 55.3 Cg_endo -69.67 -2.08 9.5 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.322 2.015 . . . . 0.0 112.824 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.9 p30 -144.35 26.88 1.44 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.773 179.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 90.6 t -133.28 141.13 45.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.102 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -157.19 94.06 1.37 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.632 179.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.72 136.55 41.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.918 -179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 38.8 t -84.63 140.79 15.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.011 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 32.0 p90 -143.87 158.76 43.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.889 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.5 tp -105.37 164.24 12.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.886 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.2 t -114.55 115.93 51.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.058 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -111.39 170.72 7.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.811 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.5 p-10 -64.47 103.81 0.71 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.817 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.3 t70 60.46 19.53 9.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.198 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -151.34 143.09 23.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.843 0.354 . . . . 0.0 110.848 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.2 tt -119.35 139.8 51.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.914 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.4 pp -122.9 135.54 62.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.177 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 64.0 mt -76.29 143.03 41.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.75 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.4 -70.88 0.75 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.11 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -154.57 173.04 16.86 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.95 0.405 . . . . 0.0 111.42 -179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -112.67 133.62 54.61 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.91 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -136.25 171.78 22.69 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.427 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 18.1 m -135.16 170.15 16.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.777 0.322 . . . . 0.0 110.898 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -58.99 -29.37 67.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.993 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.4 t -90.01 -28.29 19.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.987 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.28 -71.74 0.37 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.022 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.6 mt -69.33 -34.87 75.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.03 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.242 -0.885 . . . . 0.0 110.901 -179.955 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mtp . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.877 0.37 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.9 mt 60.05 -177.25 0.1 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.918 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.86 151.36 4.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.044 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 7.6 tt -115.73 136.31 53.19 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.9 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -119.39 175.34 5.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.853 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 17.8 mt -141.98 114.05 8.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.011 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.8 mmpp? -95.64 -177.91 4.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.876 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.94 -31.2 56.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.847 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.4 -31.24 63.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.922 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -79.42 -30.91 42.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.98 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -59.5 -45.58 91.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.993 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.445 ' HA ' ' CB ' ' A' ' 16' ' ' LYS . 4.0 mttt -82.02 -18.96 41.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.261 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.453 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 6.3 m-20 -90.5 -17.39 27.17 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.083 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.431 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 88.7 t80 -91.35 -65.48 1.01 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.22 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -90.86 -45.62 8.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.138 -179.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.445 ' CB ' ' HA ' ' A' ' 12' ' ' LYS . 2.9 ttmt -70.55 -14.56 62.55 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.393 -179.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.453 ' HB2' ' HA ' ' A' ' 13' ' ' ASP . 26.6 tp -79.65 -39.12 32.16 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 14' ' ' PHE . 0.3 OUTLIER -68.27 -43.11 78.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.711 179.734 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.51 -34.21 77.73 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.695 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -65.23 -24.62 67.39 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.002 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 133.13 41.93 0.17 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.546 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -124.34 140.67 52.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.802 0.334 . . . . 0.0 110.885 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -63.68 114.34 3.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.944 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -72.08 -32.28 66.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.4 t -60.65 -49.84 75.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.383 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 60.1 t -51.46 -35.29 16.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.439 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.41 HD13 ' CE1' ' A' ' 14' ' ' PHE . 0.4 OUTLIER -66.42 -31.81 72.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.899 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -55.24 -47.24 75.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.931 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -57.39 -20.97 33.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.135 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 53.7 t -87.66 -69.4 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.011 0.434 . . . . 0.0 111.203 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.8 mp -48.9 -54.15 5.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.083 -179.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.27 -23.32 22.28 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.608 0.242 . . . . 0.0 111.281 -179.393 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 82.0 m -89.93 -26.22 20.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.757 0.313 . . . . 0.0 111.157 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 73.0 mt -90.1 -30.49 17.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.402 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 38.1 mtm180 -95.17 20.16 9.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.722 -179.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.469 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -113.79 -55.58 2.49 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 121.1 -0.24 . . . . 0.0 111.071 179.966 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.469 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 157.43 -20.6 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.114 179.605 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.96 110.9 3.96 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.01 -179.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.22 147.76 33.55 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.53 2.154 . . . . 0.0 112.248 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.7 mt -80.89 111.9 17.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.763 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -57.67 155.32 21.86 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.137 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -67.19 -11.58 32.74 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.616 2.211 . . . . 0.0 112.531 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.94 4.77 28.2 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.405 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -94.72 19.06 10.53 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.189 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 11.3 mp0 60.29 41.33 16.6 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.88 0.371 . . . . 0.0 110.984 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.1 p-10 -88.5 96.52 10.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.851 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 56.4 m80 -143.78 177.52 8.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.895 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.88 167.3 6.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.195 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.3 mt -114.49 -179.0 3.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.917 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.3 mtpp -131.27 153.98 48.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.843 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 100.16 -109.07 3.62 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.608 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.3 mmtt -101.58 -23.35 14.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.746 0.307 . . . . 0.0 111.111 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 4.9 m95 -96.07 29.13 2.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.032 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.539 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 1.0 OUTLIER -59.04 -54.65 54.38 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.31 -179.93 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.539 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 27.1 Cg_endo -62.73 -10.49 19.92 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.267 1.978 . . . . 0.0 112.507 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -99.52 168.26 10.08 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.802 0.334 . . . . 0.0 110.834 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 -120.51 150.05 41.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.922 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -104.14 172.96 6.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.009 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.0 t -171.1 105.1 0.23 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.76 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.414 ' CG ' HD23 ' A' ' 66' ' ' LEU . 6.7 m170 -78.53 91.83 4.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.041 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.1 mp -61.78 -41.33 90.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.957 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.433 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 0.2 OUTLIER -130.45 173.84 5.34 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.488 179.968 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.433 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 18.2 Cg_exo -66.15 -4.95 11.28 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.663 2.242 . . . . 0.0 112.796 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -145.13 29.71 1.17 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.866 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 77.3 t -143.41 138.21 26.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.237 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.414 HD23 ' CG ' ' A' ' 60' ' ' HIS . 0.0 OUTLIER -154.22 110.46 3.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.413 179.664 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -112.62 133.42 54.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.035 -179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 37.8 t -91.17 142.68 12.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.785 179.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -154.33 163.3 40.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.855 0.359 . . . . 0.0 111.111 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.0 tp -110.4 169.63 8.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.776 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 18.4 t -123.19 109.38 23.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.264 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.16 161.53 18.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.8 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -43.91 -61.61 1.39 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.445 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -123.85 28.3 6.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.905 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.7 mp0 -160.16 174.33 14.42 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.843 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.4 tt -136.42 149.06 48.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.736 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.3 pp -132.4 130.09 59.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.329 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 52.0 mt -76.46 137.39 39.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.612 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.17 -69.05 0.77 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.217 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.66 153.83 23.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.372 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -113.13 126.96 56.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.667 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -144.71 -171.48 14.57 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.557 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.3 t -127.73 171.44 11.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.77 0.319 . . . . 0.0 110.841 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -60.33 -29.88 69.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.961 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 37.6 m -81.37 -24.99 36.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.008 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.19 -72.04 0.46 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.998 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.6 mp -63.24 -38.96 93.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.912 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.196 -0.907 . . . . 0.0 110.892 -179.956 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 ttp . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.734 0.302 . . . . 0.0 111.468 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.3 mt -123.59 174.34 7.49 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.997 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.0 tmmm? -71.74 152.11 43.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.867 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 tt -122.01 143.52 49.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.931 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -128.62 -175.76 3.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.898 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.7 mp -144.43 128.51 17.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.973 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.87 -175.24 2.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.909 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.22 -38.1 43.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.908 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.2 m -68.17 -41.08 82.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.915 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.406 ' CZ ' HD13 ' A' ' 78' ' ' LEU . 20.7 t80 -58.86 -30.46 67.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.938 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -62.86 -46.47 87.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.954 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.527 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 1.2 mmmm -81.92 -20.47 38.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.004 0.43 . . . . 0.0 111.185 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -90.45 -10.94 41.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.082 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.434 ' O ' HD13 ' A' ' 18' ' ' LEU . 27.7 t80 -90.59 -69.0 0.75 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.875 0.369 . . . . 0.0 111.117 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -91.15 -32.71 15.72 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -179.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.527 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -76.08 -25.81 55.88 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 120.706 -0.398 . . . . 0.0 111.444 -178.99 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.411 ' O ' ' HB3' ' A' ' 22' ' ' PHE . 0.6 OUTLIER -75.64 -33.23 60.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.017 0.437 . . . . 0.0 110.037 179.182 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.521 HD11 ' CD1' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -55.63 -42.55 75.13 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.85 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.5 pp -83.99 -0.86 53.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.479 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.01 36.24 1.59 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.883 0.373 . . . . 0.0 110.94 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.18 25.8 46.83 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.397 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.521 ' CD1' HD11 ' A' ' 18' ' ' LEU . 11.5 t80 -114.08 130.47 56.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.722 0.296 . . . . 0.0 110.806 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.402 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 4.8 t70 -72.71 116.11 12.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.951 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 20.1 p-10 -68.33 -25.07 64.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.14 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.7 m -64.71 -21.15 66.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.296 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.8 t -83.93 -40.42 15.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.474 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 pp -57.78 -36.1 71.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.804 0.335 . . . . 0.0 111.129 -179.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -57.36 -20.6 30.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.418 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -84.55 -37.49 21.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.693 0.282 . . . . 0.0 111.34 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.0 p -90.41 -36.62 8.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.849 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.4 mp -71.13 -50.03 44.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.588 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.424 HD13 ' OG1' ' A' ' 33' ' ' THR . 0.0 OUTLIER -57.91 -18.92 26.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.549 0.214 . . . . 0.0 111.462 -179.454 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.424 ' OG1' HD13 ' A' ' 32' ' ' LEU . 85.1 m -84.75 -30.85 24.35 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.9 0.381 . . . . 0.0 110.703 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 66.0 mt -89.55 -30.73 18.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.444 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 13.4 mtt-85 -93.55 20.18 7.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.774 -179.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.443 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 24.4 mttm -119.47 -55.45 2.12 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.576 0.227 . . . . 0.0 111.024 179.791 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.443 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 159.62 -20.65 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.199 179.751 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -65.89 111.24 5.92 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.028 -179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.95 -179.97 3.87 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.48 2.12 . . . . 0.0 112.2 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 44.1 mt -102.44 117.45 34.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.9 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -61.45 157.04 48.77 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.042 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -69.03 -10.28 28.71 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.582 2.188 . . . . 0.0 112.548 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.87 11.19 18.66 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.31 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.432 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.4 m-85 -88.48 5.25 43.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.26 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 63.48 36.73 11.06 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.852 0.358 . . . . 0.0 110.897 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -80.65 110.37 16.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.902 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -148.56 174.76 11.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.846 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -92.44 128.26 38.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.088 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 24.7 mt -78.66 -167.9 1.23 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.847 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.2 mmtm -130.26 164.53 24.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.85 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 79.44 -122.78 5.89 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.456 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.32 -30.23 64.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.842 0.353 . . . . 0.0 110.831 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 33.1 m95 -98.45 27.35 4.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.928 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.495 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -75.94 -50.45 3.14 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.775 -179.678 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.495 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 53.0 Cg_endo -70.75 -3.26 12.31 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.165 1.91 . . . . 0.0 112.905 -179.564 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.42 ' CD1' ' HG ' ' A' ' 79' ' ' LEU . 39.3 m-85 -114.35 167.39 10.75 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.834 0.35 . . . . 0.0 110.749 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 11.1 ttm180 -117.03 141.54 48.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.046 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -98.09 171.72 8.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.017 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.8 t -169.94 122.09 0.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.776 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 23.3 m170 -101.72 87.31 3.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.082 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.432 ' HA ' ' CD2' ' A' ' 44' ' ' PHE . 3.5 mp -64.38 -51.2 71.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.871 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.519 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 16.7 mmmt -118.32 167.7 10.96 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.205 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.519 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 55.9 Cg_endo -70.86 1.75 4.84 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.081 1.854 . . . . 0.0 112.899 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -142.17 25.02 1.94 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.778 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.1 t -140.17 149.75 21.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.177 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.8 mt -146.41 101.84 3.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.878 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -95.09 131.97 40.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.953 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 81.8 t -107.24 110.95 33.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.362 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.41 ' CE1' HD11 ' A' ' 76' ' ' LEU . 26.9 p90 -124.81 162.65 23.85 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.101 -179.36 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.5 tp -118.46 133.36 55.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.867 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 7.2 p -74.47 158.52 5.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.046 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 1.3 tptt -159.35 171.57 19.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.834 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -59.53 100.09 0.07 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.986 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 52.83 23.94 3.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.238 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -148.88 147.05 28.23 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.833 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.41 HD11 ' CE1' ' A' ' 69' ' ' TYR . 0.5 OUTLIER -121.05 151.59 39.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.92 179.915 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.2 pp -133.42 130.91 57.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.269 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.406 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 67.7 mt -80.26 124.75 29.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.785 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.42 ' HG ' ' CD1' ' A' ' 56' ' ' PHE . 0.1 OUTLIER -87.24 -62.79 1.42 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.914 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.78 162.74 16.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.933 0.397 . . . . 0.0 111.214 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -104.56 143.11 33.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.817 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -147.1 177.5 25.35 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.451 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.3 m -143.05 171.66 13.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.854 0.359 . . . . 0.0 110.984 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -60.55 -29.23 69.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.93 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.4 t -88.89 -25.23 22.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.042 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.7 -68.2 0.72 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.962 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 22.8 mt -70.14 -39.14 75.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.051 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.312 -0.851 . . . . 0.0 110.873 -179.996 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mtm . . . . . 0 N--CA 1.489 1.49 0 CA-C-O 120.8 0.333 . . . . 0.0 111.079 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 60.84 169.73 0.09 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.022 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.66 151.75 19.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.818 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.1 tt -116.01 143.73 45.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.979 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -123.6 -177.52 3.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.863 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -142.1 118.31 10.75 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.837 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -95.47 174.08 7.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.859 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 44.5 mttt -74.21 -41.84 60.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.825 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.1 p -66.66 -31.32 71.92 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.812 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -75.0 -33.86 61.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.833 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -65.0 -38.64 91.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.806 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.552 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 8.9 pttt -81.65 -25.83 35.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.094 0.473 . . . . 0.0 110.994 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.465 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 6.7 m-20 -90.66 -13.45 34.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.068 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.438 ' O ' ' CD2' ' A' ' 18' ' ' LEU . 20.5 t80 -91.7 -62.04 1.51 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.105 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.09 -43.67 9.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.287 -179.213 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.552 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 28.5 mttm -73.31 -17.08 61.35 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 120.908 -0.317 . . . . 0.0 111.477 -178.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.465 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 21.5 tp -76.79 -37.82 55.11 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.487 -0.561 . . . . 0.0 109.487 179.188 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.438 ' CD2' ' O ' ' A' ' 14' ' ' PHE . 0.4 OUTLIER -67.16 -33.08 74.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.853 179.85 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.0 mt -74.9 -35.55 62.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.84 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.39 -22.69 67.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.099 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 133.09 41.03 0.19 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.463 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -124.04 144.31 49.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.868 0.366 . . . . 0.0 110.861 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -69.24 122.55 19.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.017 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.407 ' CB ' HD11 ' A' ' 18' ' ' LEU . 28.4 p-10 -78.94 -27.63 43.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.201 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.8 -56.15 13.46 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.399 -179.476 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 14.5 p -49.37 -28.48 3.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.629 -179.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.416 HD12 ' CE2' ' A' ' 14' ' ' PHE . 0.3 OUTLIER -72.88 -33.26 65.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.9 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -55.28 -50.72 68.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.002 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -59.17 -23.92 62.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.094 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 91.1 t -77.72 -72.2 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.105 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.427 HG21 ' HG3' ' A' ' 35' ' ' ARG . 1.5 mp -49.37 -27.48 2.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.229 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.68 -36.4 80.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.858 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 61.9 m -70.59 -27.62 64.24 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.497 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 21.3 mt -90.26 -29.51 18.11 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.669 -179.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.427 ' HG3' HG21 ' A' ' 31' ' ' ILE . 10.8 mtp180 -97.09 20.21 11.67 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -179.275 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.495 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.5 OUTLIER -121.38 -55.83 1.92 Allowed 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 121.022 -0.271 . . . . 0.0 111.086 179.746 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.495 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 6.1 pttm 152.04 -20.44 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.036 0.534 . . . . 0.0 110.949 179.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.56 114.79 14.34 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.993 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.53 -179.67 4.32 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.416 2.078 . . . . 0.0 112.146 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.5 mp -108.33 142.71 38.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.962 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.06 157.88 74.23 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.107 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.66 -10.02 25.92 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.612 2.208 . . . . 0.0 112.663 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.19 20.6 8.96 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.142 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.402 ' CG ' ' O ' ' A' ' 60' ' ' HIS . 8.4 m-30 -104.14 8.48 36.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.218 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 59.42 37.26 23.21 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.875 0.369 . . . . 0.0 110.878 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.3 p-10 -79.26 104.26 9.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.874 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -169.18 176.94 5.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.876 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.31 148.16 48.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.001 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mt -96.85 178.78 5.18 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.825 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 11.6 ptpt -112.88 179.27 4.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.986 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 67.1 -145.17 45.94 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.601 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 9.4 mmtm -59.94 -20.45 57.52 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.638 0.256 . . . . 0.0 111.105 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 8.7 m95 -96.81 39.28 1.18 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.992 0.425 . . . . 0.0 110.827 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.44 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.8 OUTLIER -70.19 -49.14 18.66 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.426 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.44 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 86.2 Cg_endo -83.1 37.64 0.68 Allowed 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.572 2.181 . . . . 0.0 113.031 -179.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.43 ' CD1' ' O ' ' A' ' 55' ' ' PRO . 20.9 m-85 -136.4 172.65 12.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.698 179.651 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 27.0 ttm105 -136.14 135.17 39.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.844 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -96.0 167.63 11.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.892 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -166.56 111.93 0.8 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.807 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.405 ' N ' ' CD2' ' A' ' 60' ' ' HIS . 12.1 m170 -91.29 85.15 5.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.003 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.8 mp -58.51 -29.66 39.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.013 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.418 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 29.2 mttt -139.71 162.81 48.9 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.604 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.418 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 31.3 Cg_endo -63.71 -8.12 14.64 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.312 2.008 . . . . 0.0 112.77 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -133.3 26.52 4.15 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.591 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 60.6 t -142.72 145.44 23.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.168 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -148.46 97.76 2.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.646 179.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -91.79 135.4 33.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.01 0.434 . . . . 0.0 111.1 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 97.7 t -108.1 124.89 64.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.889 178.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.454 ' CD1' ' CD1' ' A' ' 76' ' ' LEU . 13.6 p90 -137.27 153.78 50.26 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.224 -179.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -112.55 131.9 55.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.946 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 8.1 p -78.79 159.67 4.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.062 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? -143.66 160.61 40.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.864 179.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -40.27 -32.96 0.21 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.773 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.7 p-10 -164.93 30.97 0.06 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.922 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 71.7 mt-10 -153.35 158.34 41.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.868 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.454 ' CD1' ' CD1' ' A' ' 69' ' ' TYR . 6.0 tp -123.14 137.47 54.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.416 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.0 pp -127.42 134.67 65.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.424 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 28.2 mt -86.99 124.75 33.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.858 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.43 -64.74 1.11 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.824 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -162.33 171.21 17.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.085 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -126.26 132.05 51.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.946 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -143.59 165.46 27.16 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.467 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 17.3 m -104.79 173.95 6.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.724 0.297 . . . . 0.0 110.983 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -64.36 -24.52 67.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.06 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 73.4 m -89.98 -26.83 20.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.08 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -73.91 -68.18 0.54 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.041 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 17.3 mt -72.15 -32.11 66.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.018 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.899 179.918 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mtm . . . . . 0 N--CA 1.487 1.425 0 N-CA-C 111.614 0.228 . . . . 0.0 111.614 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 mp 57.05 176.42 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.907 0.384 . . . . 0.0 111.007 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.55 172.07 8.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.77 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.9 tt -137.27 153.98 50.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.899 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -146.48 176.31 9.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.917 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.3 mt -137.74 131.24 31.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.867 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -103.28 166.06 10.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.915 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.63 -30.88 69.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.886 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.1 m -76.55 -41.73 45.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.863 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.42 ' CZ ' HD12 ' A' ' 78' ' ' LEU . 22.5 t80 -71.45 -34.88 70.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.87 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -59.85 -40.71 89.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.802 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.514 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -89.98 -15.31 32.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.276 -179.959 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.434 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 5.0 m-20 -90.36 -11.12 41.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.185 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.427 ' O ' ' CD1' ' A' ' 18' ' ' LEU . 17.2 t80 -90.74 -67.08 0.87 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.978 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -90.95 -34.37 15.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.163 -179.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.514 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -76.44 -19.42 58.08 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.508 -179.127 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.434 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 36.5 tp -82.47 -34.25 28.15 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.546 HD12 ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -50.98 -48.69 61.14 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.905 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 27.7 mt -90.16 12.86 16.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.467 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -111.09 31.65 5.89 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.878 0.371 . . . . 0.0 110.86 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.01 22.83 22.0 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.473 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.546 ' CD1' HD12 ' A' ' 18' ' ' LEU . 29.4 t80 -117.08 143.91 45.25 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.81 0.338 . . . . 0.0 110.851 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.416 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 3.9 t70 -91.92 111.05 22.43 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.856 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 36.2 p-10 -53.89 -27.31 29.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.202 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.8 t -60.73 -19.39 58.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.246 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.8 t -88.55 -40.7 13.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.691 0.281 . . . . 0.0 111.486 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 pp -57.65 -36.48 71.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.118 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -62.78 -28.01 69.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.009 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -75.06 -34.2 61.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.186 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.44 HG11 ' CD1' ' A' ' 31' ' ' ILE . 10.9 p -89.96 -47.29 14.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.395 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.44 ' CD1' HG11 ' A' ' 30' ' ' VAL . 1.6 mp -58.05 -25.14 25.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.86 0.362 . . . . 0.0 110.707 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.413 ' CD2' ' N ' ' A' ' 33' ' ' THR . 0.2 OUTLIER -70.52 -52.5 21.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.27 -179.721 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.413 ' N ' ' CD2' ' A' ' 32' ' ' LEU . 89.3 m -66.56 -23.97 66.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.918 -179.349 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 76.2 mt -89.95 -33.61 16.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.756 0.312 . . . . 0.0 111.591 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.1 mtt180 -98.81 20.22 13.48 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -179.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.514 ' O ' ' HB3' ' A' ' 37' ' ' LYS . 4.0 mtmt -108.69 -55.88 2.34 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.033 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.514 ' HB3' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 150.83 -20.38 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.122 0.569 . . . . 0.0 110.801 179.622 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.62 126.36 89.48 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.605 -0.27 . . . . 0.0 110.987 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -75.08 169.41 22.65 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.449 2.099 . . . . 0.0 112.278 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.6 mt -95.82 126.09 40.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.802 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -72.26 162.16 75.21 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.055 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -68.89 -27.54 30.65 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.609 2.206 . . . . 0.0 112.304 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -64.76 -15.54 61.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.326 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -79.17 -0.19 30.85 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.57 -0.287 . . . . 0.0 111.552 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 67.83 48.56 1.01 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.959 0.409 . . . . 0.0 110.843 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.2 p-10 -88.92 89.02 7.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.772 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -151.48 -179.88 7.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.044 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -84.46 125.08 32.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.112 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 90.0 mt -72.3 -178.57 2.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.898 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -110.15 172.75 6.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.928 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 78.21 -117.96 4.8 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.587 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.2 mttm -89.63 -18.03 27.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.578 0.228 . . . . 0.0 111.298 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 16.5 m-90 -96.18 38.26 1.2 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.805 0.336 . . . . 0.0 111.083 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.435 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 5.0 mtpt -83.96 -50.92 0.62 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.042 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 17.0 Cg_exo -66.62 -8.84 22.29 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.505 2.137 . . . . 0.0 112.475 179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -105.75 -171.64 1.94 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.904 0.383 . . . . 0.0 111.066 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.1 ttm-85 -138.92 136.22 35.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.847 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -106.19 162.79 13.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.114 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.401 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 3.1 t -162.71 117.45 1.78 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.906 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -90.28 89.47 7.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.932 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.0 mp -60.53 -31.4 48.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.069 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.5 mttm -141.42 172.86 5.45 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.765 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -66.78 -6.35 15.42 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.706 2.27 . . . . 0.0 112.663 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -142.27 26.09 1.84 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.879 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 64.5 t -141.06 140.85 32.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.184 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -159.14 110.3 2.06 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.759 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.3 131.8 54.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.712 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 41.5 t -88.68 140.45 15.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.98 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.401 ' CE2' ' HB2' ' A' ' 59' ' ' CYS . 2.6 p90 -146.77 159.36 43.6 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.918 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 2.8 tp -109.24 171.98 7.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.856 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 28.7 t -123.26 103.71 13.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.181 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.06 168.37 10.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.743 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -58.76 104.04 0.2 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.832 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 57.0 22.05 6.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.122 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -148.68 138.21 21.95 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.748 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.7 tp -108.03 143.93 36.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.933 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.2 pp -131.64 130.26 62.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.201 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.42 HD12 ' CZ ' ' A' ' 10' ' ' PHE . 74.9 mt -76.28 135.4 39.62 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.747 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.36 -62.68 1.29 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.137 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.69 164.59 18.99 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.931 0.396 . . . . 0.0 111.472 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -125.19 126.73 45.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.598 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -146.31 -174.9 18.86 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.557 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 22.7 m -110.55 174.46 5.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.91 0.386 . . . . 0.0 111.031 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.33 -25.3 65.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.981 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 69.6 m -86.93 -15.97 37.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.281 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -86.79 -69.28 0.69 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.02 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.5 mp -63.15 -41.23 99.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.079 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.208 -0.901 . . . . 0.0 110.958 179.961 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.3 mtp . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.804 0.335 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -153.73 152.6 30.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.917 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.9 151.32 47.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.892 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.2 tt -121.21 154.38 36.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.83 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -147.54 155.81 42.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.901 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.9 mp -124.78 126.78 46.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.976 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -100.52 158.97 15.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.957 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.3 tttm -61.26 -31.74 71.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.899 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 6.6 m -66.1 -28.96 69.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.032 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -73.87 -32.4 63.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.134 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -79.29 -30.08 42.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.056 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.03 -16.2 30.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.387 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -81.74 -30.48 32.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.639 0.257 . . . . 0.0 111.148 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.455 ' CE2' ' CD1' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -90.42 -53.02 4.62 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 179.538 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -51.48 -34.47 35.84 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.06 0.457 . . . . 0.0 110.074 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.54 -27.98 37.42 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.097 179.044 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.2 mt -76.12 -41.5 49.92 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.1 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.493 HD13 ' CD1' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -54.13 -33.18 57.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.992 179.914 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 mt -90.06 -5.86 56.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.617 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.64 38.01 1.24 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.846 0.355 . . . . 0.0 111.068 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.67 26.71 41.27 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.502 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.493 ' CD1' HD13 ' A' ' 18' ' ' LEU . 10.6 t80 -119.51 128.39 53.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.814 0.34 . . . . 0.0 110.88 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.41 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 8.0 t70 -84.85 131.28 34.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.996 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.7 p-10 -56.9 -21.8 32.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.099 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.6 t -48.15 -53.45 16.69 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.821 0.343 . . . . 0.0 110.955 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.41 ' HB ' ' CZ ' ' A' ' 22' ' ' PHE . 39.2 t -65.14 -35.11 74.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.669 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.455 ' CD1' ' CE2' ' A' ' 14' ' ' PHE . 1.1 tp -59.14 -33.52 70.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.669 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -59.35 -47.09 86.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.912 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -63.14 -40.06 96.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.932 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 94.6 t -66.27 -72.46 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.09 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.2 mp -45.76 -33.45 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 121.152 0.501 . . . . 0.0 110.523 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.497 ' HG ' ' HG2' ' A' ' 36' ' ' LYS . 0.3 OUTLIER -55.51 -59.97 4.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.17 179.35 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.42 ' N ' ' CD2' ' A' ' 32' ' ' LEU . 64.6 m -54.34 -24.45 19.39 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.307 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 17.7 mt -73.36 -62.08 1.6 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.844 0.354 . . . . 0.0 110.961 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.4 mtp180 -67.9 -49.0 64.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.029 0.442 . . . . 0.0 110.921 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.547 ' O ' ' CG ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -68.55 -13.77 62.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.533 179.882 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.547 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 1.3 pttm 52.59 70.73 0.54 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.679 -179.549 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.407 ' CB ' ' HD2' ' A' ' 36' ' ' LYS . 1.3 tm-20 -81.56 142.48 49.84 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.636 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -61.32 104.8 0.31 Allowed 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.366 2.044 . . . . 0.0 112.135 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 57.3 mt -68.3 137.61 54.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.99 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -87.29 158.42 52.19 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.82 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.32 -26.72 63.65 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.504 2.136 . . . . 0.0 112.224 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -67.68 -21.46 65.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.094 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.429 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.2 m-85 -56.5 -27.64 57.75 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.003 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 63.29 61.33 1.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.939 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.0 p-10 -91.45 77.35 5.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.871 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -125.89 -175.29 3.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.043 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.07 166.97 21.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.253 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -104.44 -167.55 1.37 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.885 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -126.1 151.38 47.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.864 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 92.12 -136.03 13.03 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.564 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.22 -11.81 61.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.614 0.245 . . . . 0.0 111.352 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 17.3 m-90 -96.69 39.33 1.17 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.969 0.414 . . . . 0.0 111.007 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.484 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 2.4 ttmm -72.71 -50.25 7.62 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.468 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.484 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 63.1 Cg_endo -74.43 0.43 8.61 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.336 2.024 . . . . 0.0 112.932 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -102.83 179.78 4.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.808 0.337 . . . . 0.0 110.817 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.421 ' HG2' ' CE1' ' A' ' 69' ' ' TYR . 12.1 ttm180 -147.14 134.39 20.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.833 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -95.85 162.93 13.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.002 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.422 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 21.6 t -163.87 105.91 0.93 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.847 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.434 ' CD2' ' N ' ' A' ' 60' ' ' HIS . 6.8 m170 -84.79 94.96 8.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.955 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.43 ' CD1' ' HB3' ' A' ' 67' ' ' LEU . 4.4 mp -66.09 -25.22 35.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.913 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.43 169.96 10.67 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.766 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -70.86 1.2 5.4 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.798 2.332 . . . . 0.0 112.866 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -144.38 24.06 1.6 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.845 0.355 . . . . 0.0 110.778 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.4 t -136.49 153.13 30.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.919 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.422 HD21 ' CD2' ' A' ' 60' ' ' HIS . 3.7 mt -145.56 112.27 5.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.775 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.43 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 4.7 tp -106.66 128.74 54.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.018 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 66.9 t -108.4 134.16 51.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.753 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.422 ' CE2' ' HB2' ' A' ' 59' ' ' CYS . 2.8 p90 -144.07 165.43 27.81 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.886 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.3 tp -100.24 157.53 16.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.871 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.4 t -113.31 103.82 16.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.116 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.9 tttp -83.17 161.74 21.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.719 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -44.02 -35.87 2.27 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.443 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.0 p-10 -156.0 29.66 0.36 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.82 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -152.5 156.6 39.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.814 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 11.8 tp -119.67 139.92 51.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.715 179.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.8 pp -133.35 127.95 54.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.212 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 58.9 mt -70.22 139.81 52.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.95 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.32 -73.72 0.65 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.058 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.08 174.61 13.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.875 0.369 . . . . 0.0 111.364 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -120.93 140.65 51.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.838 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -147.13 -176.85 21.2 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.572 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.1 t -139.81 -172.03 3.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.818 0.342 . . . . 0.0 110.912 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.8 t-160 -72.63 -28.66 62.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.965 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.01 -23.06 21.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.088 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -85.74 -71.12 0.55 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.874 0.368 . . . . 0.0 111.003 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 72.6 mt -60.45 -40.66 91.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.992 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.175 -0.917 . . . . 0.0 110.976 179.946 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mpp? . . . . . 0 N--CA 1.487 1.41 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.3 mt -90.65 161.28 15.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.897 0.38 . . . . 0.0 110.857 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.42 142.37 55.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.781 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 7.7 tp -114.03 154.45 27.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.013 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -138.9 176.04 9.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.832 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.0 mt -138.9 129.06 25.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.997 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 25.8 mmtm -97.21 -177.45 3.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.784 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.83 -33.85 39.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.924 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.6 m -74.59 -34.34 62.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.016 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -61.16 -29.22 69.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.075 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -71.55 -42.39 67.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.02 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.509 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 2.6 mtmm -78.54 -19.51 52.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.284 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -90.4 -10.39 44.05 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.095 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.451 ' O ' ' CD2' ' A' ' 18' ' ' LEU . 6.7 t80 -91.17 -66.03 0.96 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.801 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -91.46 -37.73 12.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.89 -0.595 . . . . 0.0 112.15 -179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.509 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -75.49 -18.27 59.89 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 120.941 -0.304 . . . . 0.0 111.677 -178.799 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.2 tt -79.81 -34.1 39.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.977 0.418 . . . . 0.0 109.891 179.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.451 ' CD2' ' O ' ' A' ' 14' ' ' PHE . 0.8 OUTLIER -66.65 -33.82 76.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.799 179.641 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.9 mt -80.57 -36.05 33.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.911 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -57.61 -22.73 47.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.086 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.98 36.7 0.27 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.687 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.406 ' CE2' ' O ' ' A' ' 23' ' ' ASP . 75.0 t80 -122.11 163.3 19.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.72 0.295 . . . . 0.0 110.951 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.406 ' O ' ' CE2' ' A' ' 22' ' ' PHE . 9.9 t70 -86.31 123.08 31.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.941 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -77.85 -31.61 51.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.985 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.0 t -60.86 -40.79 94.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.35 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 45.3 t -58.66 -37.99 68.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.341 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.83 -33.58 73.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.975 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -58.36 -29.0 65.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.122 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -72.04 -44.39 63.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.031 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.409 HG11 ' CD1' ' A' ' 31' ' ' ILE . 10.8 p -80.13 -46.15 22.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.148 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.426 HG12 ' CE2' ' A' ' 14' ' ' PHE . 1.6 mp -58.42 -29.96 39.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.921 0.391 . . . . 0.0 110.657 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.1 -24.7 65.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.166 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 51.4 m -90.21 -24.0 21.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.568 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.0 mt -90.11 -38.8 13.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.593 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 51.9 mtp85 -90.56 20.15 4.81 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.479 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 2.2 mttm -110.98 -55.76 2.45 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 121.106 -0.238 . . . . 0.0 111.012 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.479 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 155.65 -20.5 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.109 179.669 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -78.24 113.05 30.31 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.152 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -74.58 -179.55 4.95 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.545 2.163 . . . . 0.0 112.108 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.425 HD13 ' CE2' ' A' ' 69' ' ' TYR . 15.6 mt -87.78 116.1 25.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.822 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -60.9 159.38 27.21 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.999 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.46 -9.34 25.03 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.602 2.201 . . . . 0.0 112.574 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.14 8.95 24.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.293 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -92.39 11.7 25.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.658 0.266 . . . . 0.0 111.294 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 60.93 32.05 19.98 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.803 0.335 . . . . 0.0 110.984 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -69.26 98.61 1.06 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.81 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 32.5 m80 -144.27 177.17 8.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.888 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.53 129.82 34.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.135 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 21.8 mt -72.63 -178.93 2.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.868 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.3 mtmt -120.36 169.72 10.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.924 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 79.12 -118.25 4.74 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.492 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.53 -21.75 30.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.663 0.268 . . . . 0.0 111.221 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 6.2 m95 -96.27 38.71 1.18 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.848 0.356 . . . . 0.0 110.885 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.423 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 11.6 ttmt -73.77 -51.29 5.26 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.237 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.423 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 89.2 Cg_endo -79.77 47.1 2.41 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.307 2.005 . . . . 0.0 112.481 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -157.65 175.92 13.29 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.868 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 -130.96 134.39 46.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.853 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -104.83 167.64 9.59 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.982 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.3 t -171.1 115.4 0.42 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.659 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.418 ' O ' ' CG ' ' A' ' 60' ' ' HIS . 12.2 p80 -93.33 109.55 21.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.058 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.3 mp -77.92 -27.68 15.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.754 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.424 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 12.6 mtpp -133.18 168.94 15.4 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.6 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.424 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 14.8 Cg_exo -68.72 -0.3 5.89 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.634 2.222 . . . . 0.0 113.015 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -144.47 27.61 1.37 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.811 0.338 . . . . 0.0 110.801 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.3 t -136.38 148.72 27.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.037 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.0 mt -147.06 93.24 2.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.78 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.2 tp -93.81 120.45 34.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.85 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 47.7 t -94.32 135.35 28.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.04 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.44 ' CD1' ' CD1' ' A' ' 76' ' ' LEU . 29.6 p90 -147.36 168.2 22.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.101 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.6 tp -122.18 143.36 49.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.694 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -102.07 99.15 7.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.246 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.416 ' O ' ' C ' ' A' ' 73' ' ' ASP . 0.0 OUTLIER -77.44 167.09 22.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.72 179.883 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.416 ' C ' ' O ' ' A' ' 72' ' ' LYS . 1.2 p30 -30.04 -60.75 0.17 Allowed 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.196 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -143.67 30.82 1.33 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.789 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -154.51 109.44 3.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.194 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.44 ' CD1' ' CD1' ' A' ' 69' ' ' TYR . 1.6 tp -70.32 141.82 52.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.79 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.1 pp -129.8 136.54 58.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.321 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 82.0 mt -79.41 137.88 37.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.835 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.92 -72.8 0.63 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.959 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.16 174.01 15.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.191 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -120.04 131.76 55.23 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.746 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -145.4 -174.82 17.97 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.545 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 20.0 m -152.55 -173.31 4.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.905 0.383 . . . . 0.0 110.805 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 -65.72 -30.57 71.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.854 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 55.9 m -89.91 -30.27 17.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.94 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -74.77 -73.39 0.24 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.943 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 33.9 mt -65.64 -34.19 77.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.842 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.946 179.983 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 ptm . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.783 0.325 . . . . 0.0 111.268 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 20.0 mt 59.87 160.96 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.935 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.45 151.48 20.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.815 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.1 tp -116.49 148.75 40.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.852 0.358 . . . . 0.0 111.051 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -140.67 -179.13 5.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.823 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.1 mp -144.62 143.69 30.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.929 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.6 mmtt -114.88 -177.92 3.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.906 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.46 -31.46 67.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.812 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.84 -33.59 68.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.928 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -80.06 -32.13 39.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.938 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -59.94 -38.56 82.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.906 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.527 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 2.7 pttp -86.27 -22.68 26.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.165 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -90.7 -10.43 43.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.241 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.456 ' O ' ' CD1' ' A' ' 18' ' ' LEU . 93.9 t80 -90.58 -67.46 0.85 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.16 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -91.0 -31.46 16.31 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -179.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.527 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -77.91 -26.52 49.1 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.482 -179.07 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.54 -31.34 60.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.92 0.39 . . . . 0.0 110.17 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.505 HD12 ' CD1' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -55.68 -43.3 76.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.045 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.0 pp -90.11 15.02 10.95 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.494 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -113.64 33.1 5.36 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.795 0.331 . . . . 0.0 110.813 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.55 27.08 23.38 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.304 -179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.505 ' CD1' HD12 ' A' ' 18' ' ' LEU . 14.3 t80 -115.2 149.7 37.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.83 0.348 . . . . 0.0 110.824 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.455 ' N ' ' CD1' ' A' ' 22' ' ' PHE . 46.2 t0 -92.52 98.75 11.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.91 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -54.06 -30.21 47.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.244 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.4 m -58.88 -26.22 64.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.161 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 38.3 t -84.6 -36.47 11.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.299 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.422 HD12 ' CE1' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -55.53 -35.8 66.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.85 -179.925 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.432 ' O ' ' HB3' ' A' ' 32' ' ' LEU . 8.7 t-20 -53.41 -66.09 0.45 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.172 -179.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -46.9 -28.57 1.64 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.484 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 37.9 t -75.37 -69.59 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.306 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.1 mp -55.97 -24.38 17.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.082 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.432 ' HB3' ' O ' ' A' ' 28' ' ' ASN . 0.1 OUTLIER -71.23 -21.17 62.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.97 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.6 m -90.0 -33.55 16.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.881 0.372 . . . . 0.0 111.464 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.1 mt -90.17 -26.33 20.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.786 -179.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 26.6 mtt180 -99.01 20.29 13.57 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -179.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.459 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 2.7 mtmt -116.47 -55.63 2.36 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.92 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.459 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 157.45 -20.55 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.161 179.665 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -63.84 110.64 4.01 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.069 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.43 166.89 25.65 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.399 2.066 . . . . 0.0 112.235 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.5 mt -94.71 123.25 38.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.977 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -68.2 156.86 89.06 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.934 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.33 -8.8 24.48 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.678 2.252 . . . . 0.0 112.512 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -89.48 12.01 17.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.395 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -98.89 14.23 29.74 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.711 0.291 . . . . 0.0 111.249 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 56.02 36.08 26.72 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.856 0.36 . . . . 0.0 111.064 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -82.56 90.45 6.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.902 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -138.62 -178.38 5.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.873 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.36 142.03 32.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.213 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 15.3 mt -83.62 -172.25 4.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.798 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.8 mmtt -116.57 163.12 16.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.975 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.82 -136.07 18.2 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.52 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.5 mmpt? -67.22 -18.24 65.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.566 0.222 . . . . 0.0 111.225 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -96.45 31.93 2.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.741 0.305 . . . . 0.0 111.154 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 3.0 mttt -79.63 -51.38 1.19 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.911 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 23.7 Cg_exo -63.76 -11.81 28.46 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.514 2.143 . . . . 0.0 112.234 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.418 ' CE1' HD13 ' A' ' 79' ' ' LEU . 73.1 m-85 -105.17 171.87 7.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.813 0.339 . . . . 0.0 110.973 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.0 ttp85 -125.73 154.35 42.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.837 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -117.79 162.22 18.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.054 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 38.0 t -150.65 145.33 25.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.803 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.418 ' CE1' HD23 ' A' ' 66' ' ' LEU . 9.9 m170 -116.49 87.19 2.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.944 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 5.3 mp -60.01 -28.28 40.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.936 0.398 . . . . 0.0 110.645 179.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.448 ' HB2' ' CD ' ' A' ' 63' ' ' PRO . 1.3 ptmm? -160.38 169.65 9.82 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.331 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.448 ' CD ' ' HB2' ' A' ' 62' ' ' LYS . 16.7 Cg_exo -67.93 5.8 0.99 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.697 2.264 . . . . 0.0 113.662 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -139.86 26.14 2.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.55 0.214 . . . . 0.0 111.326 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 47.2 t -155.6 149.32 11.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.931 0.396 . . . . 0.0 111.506 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.418 HD23 ' CE1' ' A' ' 60' ' ' HIS . 4.2 mt -146.82 117.33 7.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.663 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -107.22 131.79 53.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.906 0.384 . . . . 0.0 111.189 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 71.3 t -105.62 118.6 53.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.811 178.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.415 ' CD2' HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -133.64 -179.24 5.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.473 -179.296 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.2 tp -125.72 169.36 12.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.826 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.6 t -121.02 100.48 9.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.255 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.85 163.63 27.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.549 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -43.18 -36.91 1.89 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.416 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -154.13 25.68 0.48 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.836 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 75.1 mt-10 -149.41 173.39 13.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.876 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.415 HD21 ' CD2' ' A' ' 69' ' ' TYR . 0.4 OUTLIER -128.53 144.61 51.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.5 179.593 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.0 pp -132.31 132.02 60.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.431 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 73.6 mt -80.62 125.92 30.61 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.643 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.425 ' HB3' ' HD2' ' A' ' 80' ' ' ARG . 0.2 OUTLIER -87.74 -63.85 1.24 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.093 -179.759 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.425 ' HD2' ' HB3' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -159.67 169.42 23.77 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.031 0.444 . . . . 0.0 111.381 179.775 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.403 ' CD1' ' N ' ' A' ' 82' ' ' GLY . 2.2 tm? -119.79 141.06 49.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.75 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.403 ' N ' ' CD1' ' A' ' 81' ' ' LEU . . . -157.03 -165.71 15.41 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.597 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 49.2 m -149.89 -175.48 5.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.787 0.327 . . . . 0.0 110.903 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 62.0 t-80 -68.51 -29.44 68.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.077 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.3 m -90.01 -23.67 21.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.187 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.11 -74.35 0.38 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.934 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 16.0 mt -68.39 -41.33 80.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.936 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.926 -179.958 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 tmm? . . . . . 0 N--CA 1.488 1.429 0 CA-C-O 120.84 0.352 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.8 mt -73.94 157.63 35.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.857 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.18 148.23 36.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.828 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.1 tt -121.56 154.88 36.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.981 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -140.4 171.23 14.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.79 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.9 mp -139.68 129.3 24.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.991 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.4 169.46 8.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.847 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -29.92 67.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.002 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.2 m -77.11 -56.52 4.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.008 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.425 ' CE2' HD13 ' A' ' 78' ' ' LEU . 62.7 t80 -58.16 -33.58 69.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.048 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -61.26 -42.85 99.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.086 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.548 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 14.0 mttm -90.13 -16.59 29.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.565 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -90.78 -11.17 40.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.496 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.516 ' O ' HD11 ' A' ' 18' ' ' LEU . 25.4 t80 -90.84 -67.56 0.84 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.206 -179.596 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -90.84 -33.13 15.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.312 -0.404 . . . . 0.0 112.082 -179.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.548 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 2.9 mttt -74.53 -28.04 60.8 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.948 -179.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 30.6 tp -70.92 -35.77 72.39 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.536 HD12 ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -57.99 -33.17 68.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.66 179.812 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 mt -90.05 -6.86 55.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.435 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -96.07 27.15 3.77 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.713 0.292 . . . . 0.0 111.215 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.71 23.03 19.5 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.73 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.536 ' CD1' HD12 ' A' ' 18' ' ' LEU . 11.8 t80 -116.61 122.99 46.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.871 0.367 . . . . 0.0 110.774 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.424 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 14.6 t0 -66.65 128.84 37.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.898 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -78.1 -3.2 41.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.517 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.2 t -82.15 -27.32 32.8 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.685 0.279 . . . . 0.0 111.106 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.3 t -80.57 -36.65 16.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.439 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.0 pp -57.1 -37.37 71.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.056 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -57.76 -24.09 55.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.204 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -78.61 -35.37 45.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.112 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.416 HG11 ' CD1' ' A' ' 31' ' ' ILE . 11.5 p -90.1 -43.49 14.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.226 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.416 ' CD1' HG11 ' A' ' 30' ' ' VAL . 1.5 mp -58.39 -33.04 46.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.772 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.435 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -60.06 -56.64 19.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.641 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.403 ' N ' ' CD2' ' A' ' 32' ' ' LEU . 85.0 m -55.59 -24.05 30.69 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.378 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.1 mt -86.61 -34.4 19.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.759 0.314 . . . . 0.0 111.214 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -103.75 20.15 18.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.436 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.7 OUTLIER -116.14 21.12 13.93 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 -179.708 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.405 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 4.4 ptmm? 44.01 31.23 0.49 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.481 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -93.86 135.44 24.88 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.897 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -74.84 138.07 22.96 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.499 2.133 . . . . 0.0 112.284 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 33.4 mt -90.2 125.44 35.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.797 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -69.22 155.25 93.93 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.839 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -68.68 -10.24 28.5 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.557 2.171 . . . . 0.0 112.532 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.3 pp0? -86.3 7.5 25.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.438 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -92.98 13.91 19.26 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.599 0.238 . . . . 0.0 111.229 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 58.04 41.23 24.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.88 0.371 . . . . 0.0 111.041 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -86.93 111.79 21.16 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.98 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 11.7 m80 -164.72 -178.35 5.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.907 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -87.18 156.47 19.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.083 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 78.0 mt -109.02 176.92 4.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.934 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -124.8 152.65 43.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.876 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.461 ' C ' ' H ' ' A' ' 53' ' ' TRP . . . 60.91 111.11 0.01 OUTLIER Glycine 0 CA--C 1.508 -0.37 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.531 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 70.38 -44.27 0.57 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.748 0.309 . . . . 0.0 110.878 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.461 ' H ' ' C ' ' A' ' 51' ' ' GLY . 3.4 m0 -104.55 36.24 2.48 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.9 0.381 . . . . 0.0 110.915 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.445 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.1 OUTLIER -74.54 -49.95 4.76 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.159 -179.949 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.445 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 96.0 Cg_endo -84.7 28.99 0.55 Allowed 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.704 2.27 . . . . 0.0 113.018 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.402 ' CD1' ' O ' ' A' ' 55' ' ' PRO . 24.2 m-85 -139.8 170.42 15.92 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.742 0.306 . . . . 0.0 110.832 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 24.6 ttm180 -128.73 139.24 52.31 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.996 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -97.61 173.19 7.26 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.804 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -169.55 109.95 0.44 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.834 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.421 ' CE1' HD22 ' A' ' 66' ' ' LEU . 9.0 m170 -87.15 78.42 8.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.853 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.4 mp -58.26 -50.97 76.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.034 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.416 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 2.3 mmmt -115.98 171.73 4.4 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.729 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.416 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 14.3 Cg_exo -68.81 -2.19 9.02 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.681 2.254 . . . . 0.0 112.947 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -145.85 29.49 1.1 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.823 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 47.9 t -139.47 147.39 24.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.217 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.421 HD22 ' CE1' ' A' ' 60' ' ' HIS . 2.0 mt -147.35 92.15 2.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.777 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -85.15 131.78 34.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.979 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 96.9 t -109.84 116.05 51.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.042 179.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 21.7 p90 -134.33 156.35 48.62 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.233 -179.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.3 tp -111.74 -179.79 3.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.891 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.0 t -130.34 108.12 15.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.095 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.68 173.89 6.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.869 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -59.59 102.78 0.16 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.888 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 55.78 25.53 8.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.101 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 84.8 mt-10 -153.43 130.34 10.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.855 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -97.31 142.64 28.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.77 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.2 pp -129.26 136.29 59.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.305 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.425 HD13 ' CE2' ' A' ' 10' ' ' PHE . 70.6 mt -87.73 132.23 34.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.645 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.74 -61.29 1.75 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.093 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.99 162.89 4.72 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.921 0.391 . . . . 0.0 111.358 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -115.36 131.25 56.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.845 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -139.15 -162.08 8.98 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.498 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 95.7 p -147.8 169.62 19.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.865 0.364 . . . . 0.0 110.819 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -59.42 -28.95 67.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.962 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 18.4 m -90.11 -20.97 22.51 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.183 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -88.52 -75.0 0.44 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.09 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 46.2 mt -56.97 -41.99 79.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.227 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.255 -0.879 . . . . 0.0 111.025 179.998 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.9 ttp . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.708 0.289 . . . . 0.0 111.504 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 11.6 mt -135.02 162.89 31.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.838 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.82 138.29 58.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.829 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 8.5 tt -116.0 154.68 29.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.927 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -135.8 172.41 13.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.827 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.4 mp -139.7 123.13 17.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.918 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -98.55 160.25 14.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.8 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.8 tttp -59.72 -34.87 73.47 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.884 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.38 -25.08 63.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.026 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.419 ' CZ ' HD12 ' A' ' 78' ' ' LEU . 36.1 t80 -85.34 -33.9 21.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.979 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -58.73 -31.63 68.48 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.086 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.442 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 11.0 mtpp -90.34 -5.23 56.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.857 -179.597 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.45 ' HB2' ' HB3' ' A' ' 81' ' ' LEU . 17.1 p30 -90.69 -17.46 26.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.808 0.337 . . . . 0.0 111.466 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.46 ' CE2' ' CD1' ' A' ' 27' ' ' LEU . 30.2 t80 -91.18 -66.77 0.9 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.309 -179.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -91.3 -43.02 10.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.032 -179.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.442 ' HB3' ' O ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -71.24 -16.73 62.51 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.675 0.25 . . . . 0.0 111.675 -178.949 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.421 ' HB2' ' C ' ' A' ' 13' ' ' ASP . 1.5 tt -80.29 -36.89 33.75 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.014 0.435 . . . . 0.0 110.014 179.3 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.438 ' CD2' ' O ' ' A' ' 14' ' ' PHE . 0.4 OUTLIER -66.8 -42.65 85.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.785 179.707 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.9 mt -60.55 -41.0 93.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.888 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.82 -27.53 63.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.911 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.96 39.89 0.21 Allowed Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.537 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.417 ' CG ' HD22 ' A' ' 17' ' ' LEU . 76.4 t80 -119.75 154.09 34.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.815 0.34 . . . . 0.0 110.823 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -68.29 132.27 46.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.922 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.422 ' CB ' HD11 ' A' ' 18' ' ' LEU . 5.5 p-10 -90.64 -26.28 19.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.024 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.8 m -68.52 -32.13 71.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.319 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.409 ' CG1' ' CE2' ' A' ' 22' ' ' PHE . 14.1 p -67.85 -30.92 50.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.412 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.46 ' CD1' ' CE2' ' A' ' 14' ' ' PHE . 1.0 OUTLIER -63.88 -36.66 84.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.021 -179.839 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -64.38 -18.82 65.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.221 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -86.95 -36.71 18.16 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.094 -179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.403 HG11 ' CD1' ' A' ' 31' ' ' ILE . 13.3 p -86.05 -47.8 16.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.369 -179.768 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.403 ' CD1' HG11 ' A' ' 30' ' ' VAL . 1.7 mp -59.58 -40.12 81.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.958 0.408 . . . . 0.0 110.105 179.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.449 ' O ' ' HG2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -52.21 -62.9 1.34 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.804 179.78 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.429 ' N ' ' CD2' ' A' ' 32' ' ' LEU . 99.3 m -51.59 -41.0 60.87 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.788 0.328 . . . . 0.0 111.139 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 78.9 mt -59.2 -36.22 74.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.71 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.404 ' HB3' ' NH1' ' A' ' 35' ' ' ARG . 3.0 mtm105 -104.18 19.99 19.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.239 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.449 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 1.4 mmpt? -108.58 15.5 23.72 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.547 0.213 . . . . 0.0 111.496 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.6 mtmt 59.43 21.52 9.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.68 0.276 . . . . 0.0 110.604 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -89.36 110.76 41.14 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.15 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.62 115.03 4.18 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.445 2.097 . . . . 0.0 112.276 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.4 mt -61.39 140.62 58.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.89 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -74.09 154.59 88.56 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.894 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.21 -12.49 35.78 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.618 2.212 . . . . 0.0 112.499 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -87.22 8.89 22.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.409 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -90.49 10.07 26.77 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.695 -0.229 . . . . 0.0 111.218 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 64.19 41.7 5.98 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.912 0.387 . . . . 0.0 110.971 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -87.88 79.71 8.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.903 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -139.66 -179.81 6.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.838 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -81.17 123.58 28.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.185 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.2 mt -72.21 -177.52 2.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.846 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.2 mttt -125.25 171.14 10.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.802 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.03 -131.27 11.64 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.467 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 19.8 mttt -63.74 -31.45 72.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.719 0.295 . . . . 0.0 110.868 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -97.5 38.97 1.22 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.96 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.439 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 19.4 mttt -73.28 -50.31 6.45 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.09 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.439 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 4.7 Cg_exo -79.81 44.84 1.8 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.883 2.389 . . . . 0.0 112.464 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.404 ' CG ' ' O ' ' A' ' 55' ' ' PRO . 82.6 m-85 -156.7 178.29 10.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.831 0.348 . . . . 0.0 110.953 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.85 131.37 40.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.841 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -95.99 171.33 8.69 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.938 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 11.5 t -171.02 118.8 0.49 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.817 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.437 ' CD2' ' N ' ' A' ' 60' ' ' HIS . 4.2 m-70 -93.3 99.98 12.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.937 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.8 mp -70.42 -53.65 21.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.904 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.435 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 0.1 OUTLIER -112.64 172.25 3.68 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.49 179.757 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.435 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 18.1 Cg_exo -65.99 -4.6 10.48 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.51 2.14 . . . . 0.0 112.931 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -143.59 28.46 1.46 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.029 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 58.4 t -140.46 143.46 29.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.334 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -159.12 111.05 2.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.792 179.742 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.401 ' CB ' HD21 ' A' ' 81' ' ' LEU . 0.1 OUTLIER -113.48 134.45 54.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.865 -179.885 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.7 t -91.88 145.91 6.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.92 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 51.7 p90 -156.17 160.13 39.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.987 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 2.6 tp -109.32 161.24 15.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.824 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.9 t -120.92 100.62 9.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.084 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.56 166.32 23.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.817 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -40.45 -32.25 0.19 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.596 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -167.35 37.7 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.829 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -160.51 102.84 1.38 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.106 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.5 tt -67.92 134.96 51.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.66 179.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.2 pp -126.37 128.65 71.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.333 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.419 HD12 ' CZ ' ' A' ' 10' ' ' PHE . 82.5 mt -74.27 149.2 40.86 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.546 179.768 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -109.81 -71.03 0.78 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.261 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.403 ' HG3' ' N ' ' A' ' 81' ' ' LEU . 0.1 OUTLIER -157.59 159.21 36.84 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.163 0.506 . . . . 0.0 111.106 -179.744 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.45 ' HB3' ' HB2' ' A' ' 13' ' ' ASP . 2.9 tm? -113.79 136.78 52.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.535 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -157.46 173.33 34.91 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.654 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.5 m -108.73 170.27 8.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.839 0.352 . . . . 0.0 110.868 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -59.09 -26.72 64.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.059 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.7 t -83.79 -27.51 28.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.136 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -81.29 -69.74 0.59 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.022 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 35.1 mt -67.6 -37.87 83.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.002 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.207 -0.901 . . . . 0.0 110.892 -179.982 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.3 mtp . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.78 0.324 . . . . 0.0 111.234 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -109.79 154.42 23.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.922 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.52 146.62 39.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.979 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 7.3 tt -122.01 152.33 39.87 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.861 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -138.88 171.36 14.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.937 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.0 mp -147.12 116.69 7.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.919 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -79.82 171.14 15.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.851 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.3 ttpt -60.71 -31.24 70.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.942 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.1 m -72.99 -50.22 24.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.884 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -59.96 -35.7 75.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.812 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -63.41 -37.28 86.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.955 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.532 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 4.7 mmtt -89.16 -22.86 22.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.084 0.468 . . . . 0.0 111.097 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.417 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 4.9 m-20 -90.95 -11.11 40.01 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.232 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.51 ' O ' HD13 ' A' ' 18' ' ' LEU . 29.3 t80 -90.86 -67.38 0.85 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.833 0.349 . . . . 0.0 111.367 -179.558 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -91.09 -33.26 15.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.193 -179.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.532 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 12.6 mmtt -76.69 -26.79 55.13 Favored 'General case' 0 C--N 1.334 -0.096 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.161 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.417 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 29.2 tp -71.8 -33.01 68.19 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.185 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.556 HD11 ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -57.16 -33.58 67.56 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.821 179.967 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.7 mt -89.91 -3.32 58.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.454 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -97.7 26.81 4.77 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.669 0.271 . . . . 0.0 110.995 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 93.26 23.07 25.5 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.786 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.556 ' CD1' HD11 ' A' ' 18' ' ' LEU . 13.0 t80 -110.26 144.19 39.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.834 0.349 . . . . 0.0 110.797 179.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.419 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 5.1 t0 -99.61 113.4 25.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.004 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -58.1 -21.03 44.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.424 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.4 m -50.28 -54.43 21.34 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.775 0.322 . . . . 0.0 111.206 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.4 t -68.6 -34.62 66.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.984 0.421 . . . . 0.0 111.156 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.8 tp -65.56 -33.57 76.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.702 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -56.54 -57.92 10.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.128 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -50.5 -25.78 4.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.466 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 58.0 t -80.98 -68.25 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.911 0.386 . . . . 0.0 111.573 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.1 mp -51.38 -46.33 34.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.842 -179.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.96 -24.6 39.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.645 0.26 . . . . 0.0 111.314 -179.579 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.4 m -82.11 -30.43 31.17 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.053 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 mt -90.13 -28.57 18.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.459 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 14.0 mtm105 -94.16 20.11 8.43 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.692 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.466 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 4.2 mttt -118.19 -55.72 2.22 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.142 -0.223 . . . . 0.0 110.946 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.466 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 7.3 pttt 156.12 -20.53 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.965 179.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -59.44 111.47 3.84 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.955 -179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 158.73 56.03 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.368 2.046 . . . . 0.0 112.164 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 13.0 mt -82.64 116.03 21.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.905 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.405 ' HB2' ' CE2' ' A' ' 44' ' ' PHE . 83.3 m-20 -62.66 158.4 51.26 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.956 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.47 -11.33 30.97 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.626 2.217 . . . . 0.0 112.505 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -93.08 17.21 11.23 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.203 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.405 ' CE2' ' HB2' ' A' ' 41' ' ' ASP . 19.6 m-85 -98.04 6.67 47.36 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.261 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 44.5 mm-40 64.8 41.61 4.95 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.848 0.356 . . . . 0.0 110.889 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -86.62 90.4 8.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.933 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 70.2 m-70 -136.67 173.16 12.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.982 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.07 158.01 32.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.156 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.8 mp -112.07 -175.43 2.69 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.832 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.3 mttm -124.04 167.68 13.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.909 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 77.29 -133.27 13.02 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.497 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 10.8 mptt -60.45 -31.66 70.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.78 0.324 . . . . 0.0 110.854 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 17.1 m95 -98.63 38.69 1.33 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.973 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.5 -53.73 16.24 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.953 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.415 ' HG2' ' CE1' ' A' ' 56' ' ' PHE . 93.8 Cg_endo -84.94 34.62 0.51 Allowed 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.644 2.229 . . . . 0.0 112.609 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.415 ' CE1' ' HG2' ' A' ' 55' ' ' PRO . 81.3 m-85 -132.25 -175.45 3.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.878 0.371 . . . . 0.0 110.879 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.11 137.59 36.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.857 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -98.66 171.33 8.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.819 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 9.7 t -167.08 111.88 0.74 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.875 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.424 ' CG ' HD21 ' A' ' 66' ' ' LEU . 10.6 m170 -90.5 82.78 5.84 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.898 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.429 ' CD1' ' HB3' ' A' ' 67' ' ' LEU . 3.5 mp -56.13 -31.72 32.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.85 0.357 . . . . 0.0 110.93 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.411 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 0.0 OUTLIER -130.59 170.38 11.28 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.653 179.932 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.411 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 11.5 Cg_exo -70.75 0.96 5.59 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.852 2.368 . . . . 0.0 112.952 -179.667 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -147.27 27.46 1.03 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.788 0.328 . . . . 0.0 110.831 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 40.6 t -135.26 152.58 32.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.08 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.424 HD21 ' CG ' ' A' ' 60' ' ' HIS . 0.8 OUTLIER -146.98 104.2 3.67 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.693 179.771 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.429 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 4.2 tp -104.95 121.75 44.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.034 -179.66 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 46.3 t -99.08 135.93 32.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.794 179.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 46.4 p90 -153.3 161.97 41.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.051 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.4 tp -109.96 169.06 8.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.777 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.1 t -127.34 106.66 15.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.133 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.43 163.34 21.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.675 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -43.62 -40.82 4.29 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.467 -179.759 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -150.04 29.25 0.73 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.897 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -151.26 151.67 32.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.828 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 37.5 tp -115.09 137.14 52.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.691 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.0 pp -130.76 131.3 64.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.275 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 41.2 mt -82.66 136.9 34.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.788 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.408 ' HG ' ' CD2' ' A' ' 56' ' ' PHE . 0.3 OUTLIER -92.29 -71.29 0.65 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.982 -179.782 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.42 165.6 35.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.138 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -122.4 123.51 41.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.806 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -138.24 -169.59 11.63 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.416 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -140.29 -178.25 5.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.79 0.328 . . . . 0.0 110.865 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 5.6 t-80 -67.99 -28.71 67.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.032 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 17.9 m -89.95 -26.9 20.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.067 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.81 -68.6 0.68 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.048 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 16.6 mt -71.75 -38.6 70.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.068 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.903 -179.982 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.4 mmm . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.8 0.333 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.1 mt 61.08 165.99 0.09 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.88 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.02 150.44 24.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.859 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 8.6 tt -116.09 144.84 43.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.086 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -133.67 -173.03 3.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.804 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.9 mp -143.91 140.77 29.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.96 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.8 165.58 11.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.819 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.84 -31.33 70.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.795 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.0 t -74.62 -47.8 30.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.941 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -59.53 -38.04 79.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.934 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -60.71 -35.11 75.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.931 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.541 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 7.3 mtmp? -85.94 -20.0 29.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.147 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -90.59 -11.51 39.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.282 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.457 ' O ' HD13 ' A' ' 18' ' ' LEU . 46.0 t80 -90.57 -66.97 0.88 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.225 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -90.96 -32.17 16.06 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.541 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -77.34 -27.29 52.67 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.263 -179.106 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.43 ' O ' ' HB3' ' A' ' 22' ' ' PHE . 1.1 tt -73.42 -33.62 65.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.936 0.398 . . . . 0.0 109.974 179.447 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.552 HD11 ' CD1' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -54.91 -42.58 72.36 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.111 -179.983 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 85.8 mt -82.88 -3.26 56.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.543 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.96 37.44 1.31 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.853 0.359 . . . . 0.0 110.983 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 82.86 25.65 48.67 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.387 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.552 ' CD1' HD11 ' A' ' 18' ' ' LEU . 8.9 t80 -116.35 132.18 56.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.755 0.312 . . . . 0.0 110.782 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.403 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 13.5 t0 -87.34 124.11 33.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.907 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -55.96 -27.43 52.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.069 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 72.7 m -57.09 -22.77 42.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.174 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.424 ' HB ' ' CZ ' ' A' ' 22' ' ' PHE . 27.1 t -83.64 -45.65 18.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.312 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.09 -35.64 73.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.905 -179.798 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -57.29 -26.75 61.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.859 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -73.89 -45.36 51.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.881 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.2 p -78.74 -47.99 22.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.274 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.4 mp -50.08 -35.95 11.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.928 0.394 . . . . 0.0 110.413 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.462 ' O ' ' CG ' ' A' ' 36' ' ' LYS . 1.0 OUTLIER -52.76 -62.6 1.54 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.419 179.448 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.401 ' N ' ' CD2' ' A' ' 32' ' ' LEU . 72.3 m -51.41 -25.74 6.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.552 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 18.8 mt -73.58 -66.54 0.68 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.789 0.328 . . . . 0.0 110.933 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.6 mtt180 -60.21 -52.0 67.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.78 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.528 ' O ' ' CG ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -68.16 -14.31 62.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.405 179.849 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.528 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 3.0 ptmt 51.96 69.17 0.7 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.583 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -79.18 136.17 57.42 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.601 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.93 104.81 0.2 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.423 2.082 . . . . 0.0 112.104 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 64.0 mt -67.47 127.76 33.89 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.009 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -80.89 157.93 71.01 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.841 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -64.49 -26.97 62.24 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 122.505 2.137 . . . . 0.0 112.239 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -62.24 -23.71 66.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.033 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -62.52 -18.48 62.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.172 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 63.82 41.76 6.59 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.822 0.344 . . . . 0.0 110.983 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -77.39 87.32 3.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.766 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -134.65 -177.67 4.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.934 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -90.43 124.2 34.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.209 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.422 HD13 ' CE3' ' A' ' 53' ' ' TRP . 15.6 mt -68.47 -177.38 0.92 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.796 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.0 mmtp -125.12 156.98 37.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.917 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 78.88 -116.85 4.43 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.552 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.9 tppt? -61.18 -30.23 70.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.742 0.306 . . . . 0.0 111.098 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.422 ' CE3' HD13 ' A' ' 49' ' ' LEU . 5.5 m-90 -114.41 47.88 1.18 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.937 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 1.4 tttt -79.59 -50.99 1.23 Allowed Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.256 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 83.4 Cg_endo -82.35 11.21 3.25 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.534 2.156 . . . . 0.0 112.853 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.421 ' CE1' HD11 ' A' ' 79' ' ' LEU . 95.6 m-85 -118.49 174.65 6.13 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.759 0.314 . . . . 0.0 110.972 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -125.42 127.15 46.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.952 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -95.98 156.38 16.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.742 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 16.5 t -160.02 131.97 6.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.785 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.427 ' CD2' HD21 ' A' ' 66' ' ' LEU . 3.4 m170 -111.04 90.83 3.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.964 -179.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.442 ' CD1' ' HB3' ' A' ' 67' ' ' LEU . 4.0 mp -55.4 -24.64 16.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.716 179.657 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.438 ' HB2' ' CD ' ' A' ' 63' ' ' PRO . 1.6 ptmt -155.15 169.82 9.67 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.392 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.438 ' CD ' ' HB2' ' A' ' 62' ' ' LYS . 16.3 Cg_exo -68.26 3.79 1.92 Allowed 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.688 2.259 . . . . 0.0 113.325 -179.463 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -138.31 30.38 2.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.703 0.287 . . . . 0.0 111.225 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 79.3 t -155.38 153.56 7.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.91 0.386 . . . . 0.0 111.244 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.427 HD21 ' CD2' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -150.34 86.91 1.42 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.481 179.657 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.442 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 4.3 tp -85.47 109.05 18.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.948 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 57.4 t -84.61 135.26 25.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.669 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -143.25 155.03 44.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.97 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -106.29 147.3 29.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.891 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.4 t -101.54 116.69 45.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.155 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.62 162.76 14.04 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.791 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -44.19 -48.89 9.3 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.594 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -139.24 29.66 2.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.971 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 -160.35 171.41 19.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.72 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.6 tp -130.9 148.59 52.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.785 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.1 pp -135.27 137.89 49.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.33 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 76.0 mt -81.68 133.58 35.37 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.651 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.421 HD11 ' CE1' ' A' ' 56' ' ' PHE . 0.3 OUTLIER -88.93 -70.42 0.65 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.972 -179.753 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -158.1 179.44 9.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.223 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -132.93 128.22 36.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.742 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -166.83 168.63 40.35 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.591 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 87.9 p -109.82 177.5 4.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.869 0.366 . . . . 0.0 110.71 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 14.7 t-80 -60.72 -26.69 67.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.007 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.44 -28.76 52.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.042 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -89.77 -71.82 0.59 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.022 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 29.0 mt -58.44 -42.94 88.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.04 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.833 179.971 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.836 0.351 . . . . 0.0 111.166 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.4 mt 60.83 -179.2 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.963 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -104.28 151.51 23.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.894 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.7 tp -117.89 143.36 46.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.869 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -130.06 171.69 12.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.878 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.2 mp -135.51 115.35 13.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.838 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.2 mmtm -82.9 169.59 15.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.772 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.0 tttt -59.94 -31.06 69.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.891 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.1 m -73.37 -46.4 49.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.888 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -61.02 -29.95 70.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.896 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -59.22 -53.72 55.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.939 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.471 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 0.6 OUTLIER -78.33 -16.69 57.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.02 0.438 . . . . 0.0 111.31 -179.961 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.411 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 8.4 m-20 -90.52 -17.71 26.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.886 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.521 ' O ' HD11 ' A' ' 18' ' ' LEU . 76.9 t80 -90.94 -68.34 0.8 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.335 -179.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.44 ' HA ' HD22 ' A' ' 18' ' ' LEU . 15.3 m-20 -90.82 -41.57 11.14 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -178.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.471 ' HB3' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -69.96 -23.92 63.25 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.205 -179.014 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.411 ' HB2' ' HA ' ' A' ' 13' ' ' ASP . 25.7 tp -73.07 -35.6 66.69 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.521 HD11 ' O ' ' A' ' 14' ' ' PHE . 0.1 OUTLIER -58.08 -43.44 87.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.854 179.855 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 20.2 mt -79.81 -4.69 53.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.393 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.69 22.85 7.59 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.759 0.314 . . . . 0.0 111.153 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 96.78 23.04 16.48 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.823 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.509 ' CD1' HD12 ' A' ' 18' ' ' LEU . 11.1 t80 -114.19 137.45 51.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.813 0.34 . . . . 0.0 110.839 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.424 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 1.9 t0 -92.68 119.65 32.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.033 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -59.17 -19.01 41.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.473 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.4 p -46.82 -49.08 20.59 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 120.698 0.285 . . . . 0.0 111.309 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.7 t -74.53 -34.61 35.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.985 0.422 . . . . 0.0 111.111 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.6 tp -64.72 -39.01 92.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.722 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -54.85 -41.94 71.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.18 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -69.8 -12.22 61.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.393 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 77.7 t -90.43 -70.94 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.847 0.356 . . . . 0.0 111.693 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.4 mp -49.46 -40.0 14.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.036 -179.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.421 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 0.3 OUTLIER -62.4 -14.63 42.47 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.369 -179.669 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 92.9 m -90.08 -30.11 17.91 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.744 0.307 . . . . 0.0 110.866 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.9 mt -88.64 -31.63 18.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.398 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 31.8 mtm180 -93.21 20.21 7.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.338 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.464 ' O ' ' CG ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -123.47 24.46 8.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.831 0.348 . . . . 0.0 111.341 -179.821 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.464 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 3.9 pttp 46.71 47.21 15.01 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.319 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -123.82 109.89 29.9 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.786 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -66.35 135.75 40.88 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.396 2.064 . . . . 0.0 112.238 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.7 mt -64.03 -178.99 0.37 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.847 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.07 160.49 38.87 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.909 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.53 -18.34 48.85 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.601 2.201 . . . . 0.0 112.438 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.59 -1.64 38.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.523 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.432 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.3 m-85 -78.41 -3.01 41.12 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.61 0.243 . . . . 0.0 111.401 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 62.39 43.62 7.96 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.883 0.373 . . . . 0.0 110.866 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -88.43 100.46 13.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.907 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 75.7 m80 -133.22 173.37 11.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.95 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -81.09 131.86 35.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.072 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 7.1 mt -81.21 -178.78 7.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.875 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.21 157.09 41.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.879 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.458 ' C ' ' H ' ' A' ' 53' ' ' TRP . . . 60.31 109.93 0.01 OUTLIER Glycine 0 CA--C 1.508 -0.402 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.516 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 70.22 -44.87 0.58 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.667 0.27 . . . . 0.0 110.966 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.458 ' H ' ' C ' ' A' ' 51' ' ' GLY . 8.3 m95 -105.09 35.7 2.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.881 0.372 . . . . 0.0 110.887 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.438 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.1 OUTLIER -68.21 -52.82 20.86 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.141 179.975 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.438 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 71.6 Cg_endo -77.79 4.51 6.01 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.435 2.09 . . . . 0.0 112.699 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.422 ' CD2' ' HG ' ' A' ' 79' ' ' LEU . 30.6 m-85 -104.0 172.62 6.7 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.832 0.348 . . . . 0.0 110.806 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 57.1 ttm-85 -133.03 137.6 46.51 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.918 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -98.96 172.32 7.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.863 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 17.7 t -166.13 129.47 2.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.76 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.453 ' CD2' ' N ' ' A' ' 60' ' ' HIS . 2.5 m-70 -99.52 84.38 2.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.067 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.432 ' HA ' ' CD2' ' A' ' 44' ' ' PHE . 2.9 mp -58.17 -28.32 34.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.031 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.42 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 14.7 mttt -137.34 168.26 17.32 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.658 -179.86 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.42 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 42.5 Cg_endo -67.61 -3.19 9.77 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.397 2.065 . . . . 0.0 112.824 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -145.04 28.6 1.23 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.656 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 51.8 t -137.73 145.79 28.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.282 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.428 HD21 ' CE1' ' A' ' 60' ' ' HIS . 6.7 mt -140.32 119.78 13.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.547 179.392 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.413 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 4.8 tp -116.16 127.88 55.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.227 -179.489 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 46.0 t -103.97 138.09 29.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.479 179.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 46.0 p90 -151.78 164.77 36.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.914 0.387 . . . . 0.0 110.993 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.3 tp -114.37 179.69 3.88 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.851 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.6 t -122.07 111.47 30.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.03 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.32 168.29 9.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.962 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -62.05 106.47 0.72 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.846 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.3 t0 58.4 21.6 8.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.103 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -156.6 147.79 22.19 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.85 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.2 tt -111.97 147.88 34.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.873 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.1 pp -130.76 135.66 59.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.227 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 89.4 mt -84.0 148.67 26.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.707 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.422 ' HG ' ' CD2' ' A' ' 56' ' ' PHE . 0.7 OUTLIER -103.45 -68.38 0.84 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.968 -179.89 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.65 171.09 19.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.073 0.464 . . . . 0.0 111.303 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -124.57 131.92 53.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.683 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -150.6 -161.91 10.27 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.712 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -139.39 168.84 18.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.81 0.338 . . . . 0.0 110.824 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -59.23 -27.78 66.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.12 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.4 m -89.99 -18.62 25.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.302 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -84.66 -67.62 0.78 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.789 0.328 . . . . 0.0 111.233 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 7.0 mp -52.52 -32.1 38.8 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.327 -179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.885 -179.999 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 mmt . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.747 0.308 . . . . 0.0 111.17 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.1 mp -75.15 138.21 41.86 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.051 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.36 163.06 3.24 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.651 179.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.3 tt -125.65 145.27 50.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.889 0.376 . . . . 0.0 110.985 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -134.15 -176.64 4.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.988 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.7 mt -145.76 136.14 24.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.907 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -104.89 171.41 7.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.816 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.43 -34.07 72.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.937 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.9 m -66.04 -31.55 72.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.915 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.8 t80 -77.26 -32.75 55.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.915 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 87.8 mm-40 -69.94 -28.98 66.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.155 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.5 pttt -90.15 -53.26 4.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.241 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -53.61 -25.51 17.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.032 0.444 . . . . 0.0 111.133 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.448 ' CZ ' HD23 ' A' ' 27' ' ' LEU . 51.6 t80 -64.14 -71.21 0.18 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.724 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.403 ' OD1' ' CD2' ' A' ' 14' ' ' PHE . 1.0 OUTLIER -68.0 -26.21 65.79 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.427 179.121 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.3 ttmm -69.97 -31.02 68.52 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.675 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.448 ' O ' ' HB3' ' A' ' 22' ' ' PHE . 33.2 tp -90.28 -40.32 12.22 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 179.089 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.556 ' N ' HD12 ' A' ' 18' ' ' LEU . 4.7 mp -53.45 -36.27 61.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.01 179.759 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.5 pp -90.08 -9.89 46.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.525 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -93.48 37.17 1.06 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.656 0.265 . . . . 0.0 111.204 -179.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.81 23.03 40.24 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.843 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.451 ' CD1' HD13 ' A' ' 18' ' ' LEU . 34.7 t80 -116.77 112.11 20.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.838 0.352 . . . . 0.0 110.783 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -57.52 146.46 29.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.083 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 20.3 p-10 -86.31 -11.31 52.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.18 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.9 t -78.62 -27.27 45.45 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.7 0.286 . . . . 0.0 110.998 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.414 HG11 ' CE1' ' A' ' 22' ' ' PHE . 10.0 p -80.02 -27.43 12.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.326 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.448 HD23 ' CZ ' ' A' ' 14' ' ' PHE . 1.5 pp -59.13 -38.57 79.97 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.107 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 15.8 t30 -59.23 -23.9 62.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.176 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -80.05 -45.32 18.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.145 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.409 ' CG2' ' CD1' ' A' ' 61' ' ' ILE . 12.4 p -77.69 -48.39 24.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.45 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.2 mp -57.05 -29.72 32.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.901 0.381 . . . . 0.0 110.43 179.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.523 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -61.36 -65.85 0.63 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.273 179.382 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.414 ' N ' ' CD2' ' A' ' 32' ' ' LEU . 85.4 m -46.23 -24.26 0.44 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.937 -179.72 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.3 mt -89.29 -49.79 6.51 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -179.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 35.3 mtt180 -83.26 -16.82 44.85 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -178.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.523 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -94.38 18.88 10.36 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.624 0.249 . . . . 0.0 111.45 -179.619 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.434 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 1.3 ptpp? 45.49 48.37 10.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.33 179.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -90.63 136.97 27.41 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.783 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -68.07 137.08 39.83 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.453 2.102 . . . . 0.0 112.288 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.6 mt -96.15 148.33 22.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.911 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.37 164.07 21.19 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.92 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.41 -29.66 45.24 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.578 2.185 . . . . 0.0 112.252 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -19.67 65.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.101 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.416 ' CE2' ' HA ' ' A' ' 61' ' ' ILE . 4.8 m-85 -62.64 -17.87 61.22 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.234 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 73.8 mm-40 66.73 38.72 3.8 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.874 0.368 . . . . 0.0 110.881 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -76.75 122.11 24.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.893 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -168.0 -178.08 3.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.877 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.19 134.76 36.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.027 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.2 mt -70.11 -176.64 1.19 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.928 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.78 -178.32 3.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.967 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 65.81 -140.47 40.4 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.528 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.0 -7.65 54.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.532 0.206 . . . . 0.0 111.369 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 5.0 m95 -96.17 37.6 1.24 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.88 0.372 . . . . 0.0 110.832 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.478 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -69.88 -50.24 17.82 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.407 179.997 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.478 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 64.0 Cg_endo -74.58 51.62 2.67 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.175 1.916 . . . . 0.0 112.66 -179.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -152.99 175.59 12.79 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.761 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.24 144.62 44.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.922 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -113.26 171.63 7.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.749 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 8.2 t -168.34 110.75 0.57 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.925 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.415 ' CE1' HD21 ' A' ' 66' ' ' LEU . 10.8 m170 -84.9 83.62 7.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.94 179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.416 ' HA ' ' CE2' ' A' ' 44' ' ' PHE . 4.0 mp -53.63 -27.59 15.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.037 179.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.43 ' HB2' ' CD ' ' A' ' 63' ' ' PRO . 0.0 OUTLIER -159.49 169.74 9.93 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.382 179.714 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.43 ' CD ' ' HB2' ' A' ' 62' ' ' LYS . 15.3 Cg_exo -68.77 5.52 1.31 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.705 2.27 . . . . 0.0 113.29 -179.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -138.9 24.69 2.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.56 0.219 . . . . 0.0 111.39 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 42.0 t -155.35 145.68 12.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 121.036 0.446 . . . . 0.0 111.603 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.415 HD21 ' CE1' ' A' ' 60' ' ' HIS . 15.7 mt -141.68 107.52 5.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.428 179.506 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.403 ' C ' ' CD1' ' A' ' 67' ' ' LEU . 2.5 tm? -99.84 134.05 43.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.933 0.397 . . . . 0.0 111.365 -179.608 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 98.6 t -113.12 119.93 61.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.879 178.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 20.3 p90 -132.97 155.7 48.65 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.953 0.406 . . . . 0.0 111.323 -179.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.6 tp -109.54 171.09 7.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.852 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 20.2 t -122.93 104.98 15.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.262 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.0 164.41 24.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.776 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -41.94 -36.19 1.03 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.55 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -157.48 27.63 0.29 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.864 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -151.36 162.75 40.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.816 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.5 tp -114.03 147.6 38.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.583 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.2 pp -136.4 126.55 40.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.373 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 78.5 mt -80.32 115.68 19.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.55 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.5 -66.58 0.64 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.09 -179.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.77 176.06 9.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.049 0.452 . . . . 0.0 111.331 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -131.86 117.44 18.51 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.714 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -120.71 -161.15 11.34 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.58 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.8 m -134.19 153.01 52.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.069 0.461 . . . . 0.0 110.912 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -49.42 -28.48 5.23 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.344 -179.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 12.7 t -90.19 -20.67 22.77 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.239 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.5 -71.22 0.47 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.152 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.3 mp -49.93 -27.46 5.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.372 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.215 -0.897 . . . . 0.0 110.916 179.982 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.948 0.404 . . . . 0.0 111.09 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 7.1 mt -86.89 167.74 14.05 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.008 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.85 146.94 40.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.874 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.2 148.3 42.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.912 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -133.56 171.14 14.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.917 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.429 HD21 ' CD1' ' A' ' 10' ' ' PHE . 4.1 mt -137.97 104.13 5.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.9 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -78.41 165.94 23.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.816 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -60.39 -38.85 85.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.812 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.8 t -68.85 -31.45 70.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.924 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.429 ' CD1' HD21 ' A' ' 6' ' ' LEU . 56.0 t80 -80.92 -37.34 29.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.936 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -57.22 -36.33 70.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.974 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.458 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 4.7 mtpm? -90.06 -17.87 26.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.14 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.42 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 3.9 m-20 -90.53 -17.26 27.34 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.276 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.5 ' O ' HD12 ' A' ' 18' ' ' LEU . 65.9 t80 -91.1 -68.43 0.79 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.425 -179.658 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.41 ' HA ' HD23 ' A' ' 18' ' ' LEU . 1.3 t0 -90.95 -40.9 11.43 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.458 ' HB3' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -70.36 -26.46 63.74 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.677 -0.409 . . . . 0.0 111.086 -179.117 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.42 ' HB2' ' HA ' ' A' ' 13' ' ' ASP . 20.5 tp -69.8 -33.32 72.2 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 179.012 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.512 HD13 ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -61.36 -30.77 70.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.802 179.904 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 21.6 mt -86.36 -32.8 20.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.066 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -60.89 -19.48 60.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.075 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 133.04 34.04 0.35 Allowed Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.574 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.512 ' CD1' HD13 ' A' ' 18' ' ' LEU . 12.1 t80 -113.2 146.51 39.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.737 0.303 . . . . 0.0 110.726 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.432 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 43.0 t0 -95.08 106.79 18.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.012 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -51.91 -24.99 7.13 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.317 -179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -50.68 -44.06 57.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.788 0.328 . . . . 0.0 111.158 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.6 t -77.28 -35.82 23.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.003 0.43 . . . . 0.0 111.059 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.9 tp -59.79 -40.31 87.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.641 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 34.0 t30 -55.94 -42.45 76.19 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.053 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -61.77 -16.62 51.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.4 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 60.8 t -90.33 -70.4 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.814 0.34 . . . . 0.0 111.807 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.2 mp -50.66 -36.47 14.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.121 -0.49 . . . . 0.0 112.219 -178.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.526 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 0.3 OUTLIER -67.24 -11.19 56.8 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 120.909 -0.316 . . . . 0.0 111.352 -179.869 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 86.3 m -90.57 -35.84 14.8 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.925 0.393 . . . . 0.0 111.048 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.7 mt -90.06 -65.04 1.05 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.912 -179.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.2 mtt180 -49.54 -21.99 1.13 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.106 -179.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -90.49 21.25 4.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.638 0.256 . . . . 0.0 111.526 -179.882 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.438 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 0.2 OUTLIER 46.1 61.66 2.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.007 0.432 . . . . 0.0 111.513 -179.935 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -119.58 144.07 36.07 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.746 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.0 141.56 40.46 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.423 2.082 . . . . 0.0 112.379 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.413 HD21 ' CE2' ' A' ' 44' ' ' PHE . 54.0 mt -84.73 141.07 30.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.925 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.29 159.47 77.67 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.874 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -61.55 -27.03 81.38 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.603 2.202 . . . . 0.0 112.241 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -64.21 -26.54 68.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.971 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.436 ' CE2' ' HA ' ' A' ' 61' ' ' ILE . 3.1 m-30 -58.25 -53.53 57.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.76 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 60.91 83.53 0.14 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.959 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -92.53 105.35 17.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.878 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -130.69 -177.2 4.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.914 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -95.07 136.65 35.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.087 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.5 mp -70.11 -168.38 0.21 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.84 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.3 mmtt -137.8 150.34 47.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.791 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.427 ' C ' ' H ' ' A' ' 53' ' ' TRP . . . 60.39 110.52 0.01 OUTLIER Glycine 0 CA--C 1.507 -0.413 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.655 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.7 tptm 70.15 -45.67 0.59 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.713 0.292 . . . . 0.0 110.953 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.427 ' H ' ' C ' ' A' ' 51' ' ' GLY . 90.9 m95 -98.95 33.25 2.4 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.964 0.412 . . . . 0.0 110.822 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.461 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 1.3 tttm -70.1 -49.41 18.6 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.673 -179.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 72.9 Cg_endo -77.31 5.85 4.79 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.419 2.079 . . . . 0.0 113.191 -179.481 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -110.06 173.36 6.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.824 0.345 . . . . 0.0 110.959 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.4 ' HB2' ' NH1' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -129.04 144.53 51.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.956 -179.858 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -106.45 179.36 4.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.888 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.6 t -170.96 120.99 0.54 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.834 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.404 ' CD2' ' N ' ' A' ' 60' ' ' HIS . 13.7 m170 -99.2 78.66 2.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.976 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.441 ' CD1' ' HB3' ' A' ' 67' ' ' LEU . 2.9 mp -59.6 -29.14 41.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.113 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.1 mtpt -135.84 168.73 16.02 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.85 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -70.03 -1.08 8.1 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.871 2.38 . . . . 0.0 112.931 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 -143.06 26.66 1.66 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.704 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 42.8 t -137.26 150.93 26.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.107 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.1 mt -147.91 87.5 1.62 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.614 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.441 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 6.4 tp -82.94 134.31 35.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.115 -179.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.411 HG11 ' N ' ' A' ' 69' ' ' TYR . 38.8 t -113.38 140.29 34.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.665 179.69 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.411 ' N ' HG11 ' A' ' 68' ' ' VAL . 52.1 p90 -155.49 162.86 40.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.111 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 2.2 tp -112.35 173.08 6.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.833 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -127.42 102.33 8.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.205 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.34 164.57 26.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.798 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -43.44 -43.91 5.54 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.58 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -145.12 26.39 1.34 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.994 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -150.46 167.36 27.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.798 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.1 tt -126.15 134.81 51.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.727 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.4 pp -125.73 132.53 70.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.446 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 92.5 mt -77.8 139.28 39.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.605 179.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -94.0 -64.56 1.07 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.013 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -168.75 171.47 8.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.988 0.423 . . . . 0.0 111.206 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -128.54 121.61 29.18 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.696 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -137.42 -165.97 10.59 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.642 -0.789 . . . . 0.0 112.575 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.4 m -152.43 -171.55 3.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.904 0.383 . . . . 0.0 110.822 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 -73.39 -28.45 62.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.044 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.47 -23.21 22.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.13 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -89.89 -68.75 0.76 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.984 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 72.8 mt -59.1 -42.84 91.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.94 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.226 -0.892 . . . . 0.0 110.911 -179.959 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 ptm . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.828 0.347 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 21.0 mt -130.72 179.61 5.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.961 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.86 150.98 26.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.866 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.5 tt -122.08 144.89 48.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.977 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -130.56 179.18 6.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.955 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -140.64 121.87 14.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.911 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -92.87 168.85 10.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.929 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -65.53 -41.17 93.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.836 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.72 -32.83 74.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.856 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 51.8 t80 -69.72 -30.87 68.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.873 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -63.88 -50.82 67.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.946 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.525 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 46.6 mttp -76.5 -14.16 60.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.993 0.425 . . . . 0.0 111.264 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.419 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 3.8 m-20 -90.42 -11.78 39.42 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.798 179.551 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.481 ' O ' ' CD1' ' A' ' 18' ' ' LEU . 37.1 t80 -90.77 -74.97 0.48 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.138 -179.687 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -90.39 -31.79 16.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.842 -179.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.525 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -77.03 -13.1 60.0 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.626 -0.429 . . . . 0.0 110.816 -179.948 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.419 ' HB2' ' HA ' ' A' ' 13' ' ' ASP . 27.2 tp -86.98 -30.99 20.84 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 178.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.481 ' CD1' ' O ' ' A' ' 14' ' ' PHE . 4.2 mp -45.57 -51.27 12.22 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.309 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.5 pp -72.42 -6.44 43.55 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.001 -179.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.2 t30 -93.29 37.63 1.04 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.745 0.307 . . . . 0.0 111.051 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.73 23.11 70.6 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.24 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.464 ' CD1' HD12 ' A' ' 18' ' ' LEU . 51.7 t80 -109.78 124.78 51.88 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.833 0.349 . . . . 0.0 110.832 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.42 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 18.0 t0 -64.67 141.36 58.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.927 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -94.0 -20.62 19.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.352 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.6 m -76.64 -26.43 54.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.831 0.348 . . . . 0.0 111.286 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 13.7 p -78.76 -33.29 16.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.373 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 pp -62.04 -36.95 83.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.043 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -58.89 -24.81 62.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.046 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.407 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 9.8 mt-10 -75.62 -33.95 60.54 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.1 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.4 p -90.7 -34.52 6.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.557 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.5 mp -70.56 -48.05 61.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.749 -179.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.496 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 0.5 OUTLIER -60.19 -16.08 29.98 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.523 0.194 . . . . 0.0 111.523 -179.395 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 88.6 m -90.18 -26.63 20.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.659 0.266 . . . . 0.0 111.115 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.5 mt -87.32 -46.72 9.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.398 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 68.8 mtp180 -74.22 -5.49 42.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.794 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -97.97 25.29 6.14 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.757 0.313 . . . . 0.0 111.438 -179.661 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.471 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 53.6 pttt 46.53 29.96 1.01 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.24 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -90.25 130.55 41.56 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.791 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -75.89 148.94 32.56 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.442 2.095 . . . . 0.0 112.422 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 16.0 mt -90.59 142.24 27.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.888 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.423 ' HB2' ' CE1' ' A' ' 44' ' ' PHE . 1.6 m-20 -73.71 157.25 87.72 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.03 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.6 -9.76 26.47 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.604 2.203 . . . . 0.0 112.557 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -96.23 30.97 2.31 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.766 0.317 . . . . 0.0 110.94 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.428 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.3 m-30 -100.42 -11.17 20.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.305 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 65.95 44.92 2.6 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.851 0.358 . . . . 0.0 110.925 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.9 p-10 -89.15 76.93 7.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.888 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -119.82 176.79 5.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.915 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.91 136.25 38.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.064 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.5 mp -78.13 -172.69 2.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.914 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.0 mmtm -130.41 171.39 13.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.95 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.19 -128.17 11.47 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.5 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.7 mmtp -69.98 -23.25 63.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.705 0.288 . . . . 0.0 110.978 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 18.9 m-90 -96.68 31.82 2.22 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.889 0.376 . . . . 0.0 110.998 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.427 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.2 OUTLIER -66.12 -51.45 45.3 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.064 179.905 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.427 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 98.7 Cg_endo -80.09 46.56 2.27 Favored 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.422 2.081 . . . . 0.0 112.487 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -154.96 179.11 9.44 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.918 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 -139.69 138.98 36.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.872 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -98.44 176.77 5.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.425 ' HB2' ' CZ ' ' A' ' 69' ' ' TYR . 12.0 t -170.72 102.64 0.24 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.881 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.42 ' CD2' HD23 ' A' ' 66' ' ' LEU . 10.7 m170 -83.2 82.98 8.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.032 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.433 ' CD1' ' HB3' ' A' ' 67' ' ' LEU . 2.7 mp -61.65 -35.12 65.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.077 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.408 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 7.6 mmmt -131.03 169.32 14.02 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.673 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.408 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 16.9 Cg_exo -66.83 -5.29 12.95 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.634 2.223 . . . . 0.0 112.79 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -142.92 27.48 1.63 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.829 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 98.0 t -135.52 137.98 48.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.177 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.42 HD23 ' CD2' ' A' ' 60' ' ' HIS . 9.0 mt -139.86 93.79 2.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.794 179.559 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.433 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 2.6 tp -92.36 119.24 31.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.844 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 50.3 t -93.74 136.05 26.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.021 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.425 ' CZ ' ' HB2' ' A' ' 59' ' ' CYS . 2.2 p90 -147.8 158.61 44.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.759 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -104.28 144.35 31.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.866 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 8.7 p -82.83 158.96 3.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.021 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.44 155.84 31.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.926 179.599 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.67 107.29 0.49 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.003 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 58.29 23.41 10.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.116 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -158.1 154.66 27.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.886 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.6 tp -133.89 140.24 46.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.723 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.0 pp -122.64 134.61 65.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.189 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 71.3 mt -74.19 151.94 39.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.912 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.62 -68.62 0.92 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.884 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.62 168.81 25.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.078 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -118.63 133.95 55.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.733 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -150.3 -164.57 11.96 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.58 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.4 p -144.48 171.78 13.88 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.724 0.297 . . . . 0.0 110.832 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -58.65 -28.33 65.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.016 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.2 t -86.38 -30.05 22.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.94 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.37 -74.93 0.31 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.906 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 34.7 mt -60.25 -34.61 73.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.854 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.85 179.982 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 mtp . . . . . 0 N--CA 1.488 1.435 0 CA-C-O 120.851 0.358 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.1 mt 60.35 -171.14 0.14 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.98 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.66 156.47 13.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.908 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 7.1 tt -124.68 151.37 45.03 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.977 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -138.13 174.28 10.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.852 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.0 mt -127.67 142.58 51.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.871 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.5 mmpt? -112.93 164.55 13.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.907 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.3 pttt -54.71 -53.21 57.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.183 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.8 m -57.62 -37.68 73.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.121 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.43 ' CZ ' HD11 ' A' ' 78' ' ' LEU . 36.0 t80 -62.45 -27.69 69.29 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.99 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -77.7 -38.47 47.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.092 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.412 ' O ' ' CB ' ' A' ' 16' ' ' LYS . 6.1 ptmt -89.96 -8.59 51.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.601 -179.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -90.44 -23.52 20.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.792 0.33 . . . . 0.0 111.116 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.462 ' CE1' HD23 ' A' ' 18' ' ' LEU . 37.1 t80 -90.29 -68.86 0.76 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.439 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -49.96 -33.07 16.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.995 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.412 ' CB ' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -79.45 -23.66 42.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.862 179.715 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.451 ' HG ' ' CG ' ' A' ' 22' ' ' PHE . 36.6 tp -86.46 -50.53 6.81 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.462 HD23 ' CE1' ' A' ' 14' ' ' PHE . 4.2 mm? -50.55 -36.08 32.77 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.1 179.749 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 27.0 mt -90.01 -7.75 53.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.798 -179.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -93.77 35.85 1.12 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.877 0.37 . . . . 0.0 111.149 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 80.11 22.85 62.42 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.684 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.451 ' CG ' ' HG ' ' A' ' 17' ' ' LEU . 71.7 t80 -98.72 107.96 20.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.783 0.325 . . . . 0.0 110.609 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -52.77 124.13 13.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.037 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -62.43 -38.4 89.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.119 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.6 t -54.1 -24.59 18.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.245 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 34.5 t -79.61 -35.48 16.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.286 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.67 -35.99 71.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.954 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -63.7 -15.86 59.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.36 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -90.1 -35.58 15.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.694 0.283 . . . . 0.0 111.328 -179.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.0 p -90.63 -36.05 7.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -179.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.6 mp -76.21 -42.07 37.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 111.642 0.238 . . . . 0.0 111.642 -179.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.532 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -64.51 -14.37 56.97 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.447 -179.553 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.411 ' N ' HD21 ' A' ' 32' ' ' LEU . 99.9 m -90.36 -25.68 20.32 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 120.767 0.317 . . . . 0.0 110.904 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.8 mt -86.3 -36.78 19.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.555 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.6 mtp-105 -93.5 20.36 7.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.643 -179.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.532 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -126.85 18.71 7.24 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.598 0.222 . . . . 0.0 111.598 -179.793 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.458 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 12.4 pttm 45.72 30.01 0.76 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.907 0.384 . . . . 0.0 111.085 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.02 148.13 78.11 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.9 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -74.44 161.4 40.19 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.5 2.133 . . . . 0.0 112.463 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.2 mt -130.14 123.4 30.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.991 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.61 156.91 29.86 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.914 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -62.34 -24.17 75.63 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.543 2.162 . . . . 0.0 112.281 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.51 -23.7 67.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.037 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.423 ' O ' ' CD2' ' A' ' 60' ' ' HIS . 44.6 m-85 -69.34 -10.54 58.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.455 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 58.91 34.69 23.79 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.861 0.362 . . . . 0.0 111.066 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -66.4 78.11 0.1 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.837 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 73.1 m80 -138.95 177.62 7.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.019 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.31 137.02 44.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.09 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.89 -171.09 1.22 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.819 179.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -144.1 149.78 37.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.929 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.418 ' C ' ' H ' ' A' ' 53' ' ' TRP . . . 65.98 109.17 0.01 OUTLIER Glycine 0 CA--C 1.506 -0.474 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.841 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.4 mptt 69.18 -45.95 0.56 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.528 0.204 . . . . 0.0 111.181 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.418 ' H ' ' C ' ' A' ' 51' ' ' GLY . 17.8 m95 -101.95 33.93 2.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.855 0.359 . . . . 0.0 111.073 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.441 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 22.9 tttm -64.15 -49.42 73.66 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.303 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.441 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 89.1 Cg_endo -79.76 46.89 2.35 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.362 2.041 . . . . 0.0 112.745 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.417 ' CE1' HD11 ' A' ' 79' ' ' LEU . 69.1 m-85 -153.02 -176.51 5.8 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.732 0.301 . . . . 0.0 110.962 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 18.5 ttm105 -137.33 141.99 41.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.153 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -106.81 161.97 14.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.793 179.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 9.1 t -171.27 100.24 0.2 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.906 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.44 ' O ' ' CG ' ' A' ' 60' ' ' HIS . 26.8 p80 -86.58 108.56 18.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.067 0.461 . . . . 0.0 110.827 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.6 mp -77.53 -31.9 18.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.852 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.521 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 5.6 mmtp -128.05 161.5 55.61 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.293 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.521 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 29.0 Cg_endo -62.98 -6.02 8.73 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.307 2.005 . . . . 0.0 112.747 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -135.84 25.81 3.34 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.694 179.556 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 54.8 t -137.33 146.76 27.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.137 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.7 mt -144.25 102.94 3.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.731 179.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.409 ' C ' ' CD1' ' A' ' 67' ' ' LEU . 3.3 tm? -92.58 131.19 37.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.008 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 87.5 t -109.84 115.59 50.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.828 178.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 27.2 p90 -128.19 149.96 50.22 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.268 -179.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.411 HD12 ' CE1' ' A' ' 56' ' ' PHE . 0.4 OUTLIER -113.73 155.23 25.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.857 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -107.04 129.95 59.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.176 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.47 173.2 7.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.784 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -56.92 101.93 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.912 0.387 . . . . 0.0 110.981 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 54.85 23.48 4.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.149 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -150.68 133.91 16.2 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.938 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.6 tp -105.04 152.09 23.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.755 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.0 pp -138.29 142.89 34.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.429 -179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.43 HD11 ' CZ ' ' A' ' 10' ' ' PHE . 58.1 mt -93.81 123.31 37.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.434 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.417 HD11 ' CE1' ' A' ' 56' ' ' PHE . 0.1 OUTLIER -77.44 -60.37 2.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.078 -179.635 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.87 167.05 4.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.081 0.467 . . . . 0.0 111.65 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.402 ' CD1' ' N ' ' A' ' 82' ' ' GLY . 2.9 tm? -116.8 143.52 45.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.582 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.402 ' N ' ' CD1' ' A' ' 81' ' ' LEU . . . -165.93 -165.63 23.59 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.841 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.0 p -138.84 -178.84 5.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.764 0.316 . . . . 0.0 110.795 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -62.89 -23.42 67.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.182 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.7 m -83.29 -30.19 27.76 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.163 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -86.03 -67.95 0.77 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.014 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.6 mp -56.15 -32.39 64.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.055 -179.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.941 -179.96 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.306 0 CA-C-O 120.784 0.326 . . . . 0.0 111.188 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 7.1 mt -98.24 153.51 18.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.835 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.61 145.95 50.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.824 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -113.59 151.43 31.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.945 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -137.13 -173.01 3.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.764 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.0 mp -144.73 136.84 26.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.976 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.55 172.7 6.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.938 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.2 mtmt -67.96 -46.16 72.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.949 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 35.3 m -59.69 -42.41 92.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.872 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.422 ' CZ ' HD13 ' A' ' 78' ' ' LEU . 11.5 t80 -60.54 -36.85 79.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.746 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -63.53 -47.47 81.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.845 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.538 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 9.7 mttt -72.6 -23.47 60.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.102 0.477 . . . . 0.0 111.027 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.409 ' C ' ' HB2' ' A' ' 17' ' ' LEU . 82.7 m-20 -90.41 -10.28 44.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.057 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.465 ' O ' ' CD2' ' A' ' 18' ' ' LEU . 10.1 t80 -90.85 -68.4 0.79 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.904 179.757 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -91.38 -36.7 13.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.214 -179.489 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.538 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 2.1 ttmt -76.21 -16.58 59.8 Favored 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 120.89 -0.324 . . . . 0.0 111.689 -178.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.409 ' HB2' ' C ' ' A' ' 13' ' ' ASP . 0.5 OUTLIER -81.88 -35.31 29.4 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.137 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.465 ' CD2' ' O ' ' A' ' 14' ' ' PHE . 1.4 mt -61.53 -35.76 78.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.952 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 pp -89.93 11.58 20.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.348 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -114.06 28.69 8.56 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.859 0.362 . . . . 0.0 110.945 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.04 25.03 32.84 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.647 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.441 ' CD2' ' N ' ' A' ' 23' ' ' ASP . 50.9 t80 -115.09 164.22 14.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.775 0.321 . . . . 0.0 110.872 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.441 ' N ' ' CD2' ' A' ' 22' ' ' PHE . 11.9 t70 -98.65 114.99 27.69 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.965 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -66.44 -31.16 71.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.893 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.1 t -56.7 -37.0 70.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.186 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 46.9 t -60.76 -35.71 66.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.204 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.422 ' HG ' ' N ' ' A' ' 28' ' ' ASN . 0.6 OUTLIER -65.48 -33.76 76.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.791 -179.815 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.422 ' N ' ' HG ' ' A' ' 27' ' ' LEU . 8.1 t-20 -65.9 -14.38 61.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.4 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.445 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 3.1 mt-10 -90.14 -33.76 16.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.731 0.301 . . . . 0.0 111.113 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.412 HG11 ' N ' ' A' ' 31' ' ' ILE . 8.0 p -90.82 -43.06 14.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.659 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.412 ' N ' HG11 ' A' ' 30' ' ' VAL . 1.6 mp -62.26 -57.73 10.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.639 -179.248 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.597 ' O ' ' HG2' ' A' ' 36' ' ' LYS . 0.9 OUTLIER -49.55 -21.43 0.98 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -178.855 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.415 ' N ' HD22 ' A' ' 32' ' ' LEU . 89.1 m -90.08 -34.23 16.0 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.676 0.274 . . . . 0.0 111.24 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 83.0 mt -86.43 -30.84 21.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.668 -179.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.405 ' HG3' HG22 ' A' ' 31' ' ' ILE . 2.2 mtt85 -92.38 20.18 6.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.745 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.597 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -113.74 -50.94 2.82 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.796 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.537 ' H ' ' HG3' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 153.93 -20.65 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 122.699 0.4 . . . . 0.0 111.008 179.752 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -64.08 111.44 5.44 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.173 -179.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -78.82 131.48 10.19 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.508 2.139 . . . . 0.0 112.273 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 6.7 mt -59.57 166.95 2.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.926 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -108.73 163.28 17.33 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.09 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.94 -12.75 31.08 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.618 2.212 . . . . 0.0 112.545 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 -82.91 2.95 31.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.374 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -95.23 20.97 8.47 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.708 0.29 . . . . 0.0 111.185 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 61.18 46.72 7.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.897 0.379 . . . . 0.0 111.037 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.4 p-10 -89.52 96.61 10.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.937 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 21.6 p-80 -152.08 -178.07 6.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.931 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -87.02 128.48 35.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.13 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.6 mp -65.62 -175.78 0.3 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.889 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.1 mtmt -117.34 161.19 19.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.898 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.95 -116.52 4.68 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.575 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.14 -14.75 21.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.601 0.239 . . . . 0.0 111.313 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 19.3 m95 -96.24 31.08 2.28 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.061 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.4 OUTLIER -75.53 -51.44 3.2 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.028 179.844 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 50.9 Cg_exo -54.01 -18.69 13.83 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.424 2.082 . . . . 0.0 112.437 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -98.89 175.07 6.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.854 0.359 . . . . 0.0 110.992 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -128.61 132.54 48.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.877 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -95.96 172.76 7.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.072 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 3.2 t -170.18 116.19 0.52 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.638 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.6 m170 -88.57 84.62 6.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.111 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.5 mp -59.05 -27.89 37.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.85 179.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.411 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 7.1 mttp -139.62 168.92 13.47 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.538 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.411 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 17.2 Cg_exo -66.92 -2.93 8.65 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.653 2.235 . . . . 0.0 112.884 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -145.42 29.56 1.15 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.914 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 42.2 t -139.6 151.25 22.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.215 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -157.09 104.09 2.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.595 179.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.1 tp -105.2 116.65 32.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.669 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 34.1 t -85.43 141.86 13.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.222 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.419 ' CD1' HD12 ' A' ' 76' ' ' LEU . 38.3 p90 -147.41 163.6 35.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.963 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.82 157.14 21.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.867 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -111.44 115.02 48.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.099 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.1 163.62 16.13 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.857 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -42.75 -35.61 1.2 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.55 -179.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -156.62 26.53 0.34 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.084 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -149.37 155.88 41.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.768 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.419 HD12 ' CD1' ' A' ' 69' ' ' TYR . 9.8 tp -113.73 132.16 55.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.723 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.2 pp -126.3 130.39 71.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.367 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.422 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 72.7 mt -74.13 142.18 45.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.637 179.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.82 -75.55 0.56 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.169 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -146.95 179.6 7.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.84 0.352 . . . . 0.0 111.287 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -139.6 134.9 32.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.765 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -179.73 176.53 47.62 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.586 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.6 m -112.42 175.32 5.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.829 0.347 . . . . 0.0 110.827 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -59.79 -32.04 70.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.852 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -78.77 -21.32 48.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.045 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.15 -49.69 6.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.833 0.349 . . . . 0.0 110.845 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.4 mt -82.4 -40.94 20.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.977 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.935 -179.964 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.9 ttp . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 120.77 0.319 . . . . 0.0 111.535 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -129.92 158.34 39.78 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.895 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.45 152.53 21.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.029 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 7.7 tt -128.54 138.43 52.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.744 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -119.59 179.06 4.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.987 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -147.08 122.74 10.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.818 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.4 mttp -103.17 169.3 8.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.871 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 7.0 tttt -65.83 -43.58 88.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.855 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.5 m -58.76 -29.88 67.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.974 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.419 ' CE1' HD13 ' A' ' 67' ' ' LEU . 38.7 t80 -77.14 -41.56 41.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.949 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -58.82 -45.13 90.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.866 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.476 ' O ' ' N ' ' A' ' 16' ' ' LYS . 2.7 mmmt -73.51 -45.06 56.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.026 0.441 . . . . 0.0 110.717 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.576 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -49.3 -25.76 2.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.982 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.49 ' O ' HD13 ' A' ' 18' ' ' LEU . 75.9 t80 -91.49 -72.47 0.58 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.033 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.516 ' HA ' HD13 ' A' ' 18' ' ' LEU . 9.1 t70 -51.01 -45.3 61.16 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.357 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.476 ' N ' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -72.94 -13.5 61.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.36 -179.853 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.576 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 5.6 mt -90.34 -53.49 4.43 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 121.025 0.44 . . . . 0.0 110.356 179.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.516 HD13 ' HA ' ' A' ' 15' ' ' ASP . 0.5 OUTLIER -52.32 -33.87 44.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.219 -179.855 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.3 pp -90.06 13.94 13.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.237 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -123.79 13.29 9.24 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.556 0.217 . . . . 0.0 111.406 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.41 29.16 5.77 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.787 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -110.73 118.13 35.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.888 0.375 . . . . 0.0 110.779 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -58.51 119.89 7.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.871 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -66.17 -30.3 70.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.952 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 94.1 p -57.23 -27.51 62.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.153 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 31.4 t -71.96 -37.83 62.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.336 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.415 ' HG ' ' N ' ' A' ' 28' ' ' ASN . 1.0 OUTLIER -59.76 -34.94 73.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.02 -179.819 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.415 ' N ' ' HG ' ' A' ' 27' ' ' LEU . 6.0 t-20 -61.25 -18.15 56.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.283 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.413 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 51.1 mt-10 -88.98 -35.76 16.22 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.78 0.324 . . . . 0.0 111.331 -179.759 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 15.0 p -90.69 -31.13 5.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.932 -179.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.5 mp -75.35 -47.98 32.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.658 -179.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.496 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 0.6 OUTLIER -56.34 -22.69 32.48 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.134 -179.539 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.4 m -85.39 -27.39 25.84 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.673 0.273 . . . . 0.0 111.208 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.2 mt -84.64 -33.72 23.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.312 -179.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -96.68 20.35 10.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.303 -179.89 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.534 ' O ' ' HG3' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -119.29 27.08 9.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.409 -179.768 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.534 ' HG3' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 35.6 36.14 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.67 -179.906 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -102.79 132.71 20.96 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.667 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -74.66 138.31 23.75 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.407 2.071 . . . . 0.0 112.524 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 6.0 mt -88.22 134.49 33.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.702 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -61.79 152.94 74.19 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.007 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.64 -8.25 23.18 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.532 2.155 . . . . 0.0 112.682 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.14 6.76 27.76 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.344 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -90.02 9.12 29.21 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.583 0.23 . . . . 0.0 111.316 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 36.2 mm-40 57.77 41.01 25.73 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.939 0.399 . . . . 0.0 111.057 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -87.54 86.56 7.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.984 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -139.84 -172.0 3.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.952 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.58 148.77 44.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.199 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.7 mp -84.74 177.68 7.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.875 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.18 156.76 22.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.89 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.95 -131.46 10.75 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.609 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.42 -13.92 50.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.56 0.219 . . . . 0.0 111.276 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 8.9 m95 -95.49 23.83 5.68 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.661 0.267 . . . . 0.0 111.291 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.463 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.4 OUTLIER -60.67 -49.16 90.95 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.047 179.988 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.463 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 36.9 Cg_exo -57.42 -16.85 24.73 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.449 2.099 . . . . 0.0 112.43 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.424 ' CD2' ' HG ' ' A' ' 79' ' ' LEU . 96.7 m-85 -93.3 176.31 6.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.867 0.365 . . . . 0.0 111.02 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 22.2 ttm180 -132.29 137.88 47.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.899 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -95.91 176.19 6.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.046 -179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 3.0 t -169.06 107.01 0.43 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.888 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 7.0 m170 -92.08 77.4 5.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.847 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.444 ' CD1' ' HB3' ' A' ' 67' ' ' LEU . 4.3 mp -58.28 -28.97 36.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.061 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.3 mtpm? -139.06 169.47 12.38 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.875 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_exo -70.7 -2.47 10.9 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.77 2.313 . . . . 0.0 112.838 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -139.55 27.1 2.29 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.836 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 46.2 t -140.13 149.97 21.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.016 0.436 . . . . 0.0 111.1 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -148.6 91.46 1.89 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.608 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.444 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 2.4 tp -91.42 122.76 34.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.962 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 56.0 t -99.15 133.46 41.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.912 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.424 ' CE1' HD12 ' A' ' 76' ' ' LEU . 23.7 p90 -140.95 172.49 12.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.92 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.7 tp -118.5 136.12 54.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.872 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 8.7 p -80.67 159.29 4.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.172 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.75 156.54 44.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.895 179.381 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -40.9 -32.3 0.22 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.837 -179.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -165.6 33.57 0.05 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.759 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -156.67 163.5 39.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.949 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.424 HD12 ' CE1' ' A' ' 69' ' ' TYR . 11.8 tp -125.9 139.62 53.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.712 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.8 pp -129.46 129.8 67.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.171 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 66.8 mt -73.29 146.22 45.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.882 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.424 ' HG ' ' CD2' ' A' ' 56' ' ' PHE . 0.1 OUTLIER -112.98 -70.75 0.79 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.009 -179.891 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.87 157.48 37.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.041 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -111.49 133.7 53.59 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.032 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -136.99 -167.91 11.24 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.371 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.6 m -151.13 162.23 41.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.844 0.354 . . . . 0.0 110.795 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -55.75 -28.0 53.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.752 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 64.8 m -89.93 -27.43 19.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.826 179.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.06 -70.91 0.47 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.987 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 17.9 mt -68.81 -37.07 78.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.967 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.884 179.968 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 mtp . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.846 0.355 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -151.23 162.7 40.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.845 179.968 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.63 150.51 32.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.973 -179.958 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.0 tt -119.33 148.08 43.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.833 179.945 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -135.14 -177.58 4.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.9 -179.96 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.433 ' CD2' ' CD2' ' A' ' 10' ' ' PHE . 17.2 mt -146.73 133.6 20.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.975 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.4 mmmt -104.34 174.76 5.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.969 179.94 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.7 tttm -64.98 -33.11 75.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.951 -179.975 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 m -69.52 -46.62 66.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.972 179.96 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.433 ' CD2' ' CD2' ' A' ' 6' ' ' LEU . 23.5 t80 -59.74 -30.08 68.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.98 -179.994 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.0 mm-40 -60.42 -46.12 91.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.0 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.486 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 0.7 OUTLIER -73.85 -19.85 60.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.047 0.451 . . . . 0.0 111.174 -179.993 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -90.46 -16.96 27.99 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.984 179.708 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.513 ' O ' HD11 ' A' ' 18' ' ' LEU . 20.4 t80 -90.99 -68.54 0.78 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.434 -179.506 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.406 ' HA ' HD23 ' A' ' 18' ' ' LEU . 38.8 t70 -91.01 -40.51 11.61 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -178.903 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.486 ' HB3' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -70.89 -24.8 62.55 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.35 -178.979 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 27.4 tp -72.54 -34.47 67.56 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 179.151 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.524 HD12 ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -57.63 -31.11 65.92 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.733 179.859 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 14.4 mt -89.97 -6.56 55.53 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.442 -179.984 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.68 28.3 3.48 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.732 0.301 . . . . 0.0 111.105 -179.861 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 92.89 23.05 26.43 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.814 179.804 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.524 ' CD1' HD12 ' A' ' 18' ' ' LEU . 11.1 t80 -113.79 135.44 53.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.857 0.361 . . . . 0.0 110.768 179.81 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.414 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 18.6 t0 -93.39 122.1 35.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.923 -179.98 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -58.3 -20.57 43.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.429 179.959 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 t -50.57 -55.42 16.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.732 0.301 . . . . 0.0 111.195 -179.88 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 37.9 t -67.2 -34.87 72.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.079 -179.952 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.4 tp -62.99 -29.93 71.2 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.715 179.949 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -63.5 -22.88 67.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.212 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -87.07 -18.16 31.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.351 -179.896 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 66.3 t -90.26 -69.53 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.003 0.43 . . . . 0.0 111.613 -179.705 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.423 HG12 ' CE1' ' A' ' 14' ' ' PHE . 1.2 mp -48.42 -44.01 13.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.231 -178.975 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.402 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -60.8 -15.94 35.4 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 121.079 -0.248 . . . . 0.0 111.568 -179.418 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 85.7 m -90.08 -36.27 14.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.759 0.314 . . . . 0.0 111.025 179.94 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.9 mt -82.34 -29.61 30.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.331 -179.586 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 22.0 mtt180 -94.62 20.31 8.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.398 -179.76 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.474 ' O ' ' CG ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -126.68 26.76 6.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.068 -179.822 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.474 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 0.6 OUTLIER 47.33 53.67 10.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.178 -179.82 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -128.45 102.78 20.31 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.703 179.944 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -68.09 136.67 38.53 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.396 2.064 . . . . 0.0 112.341 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.42 HD22 ' CD2' ' A' ' 44' ' ' PHE . 1.2 mp -74.1 158.21 34.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.993 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.19 164.28 53.15 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.005 -179.909 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.53 -13.34 38.72 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.61 2.207 . . . . 0.0 112.487 179.941 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -86.89 7.49 27.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.421 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.42 ' CD2' HD22 ' A' ' 40' ' ' LEU . 4.8 m-85 -93.53 14.17 19.61 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.109 179.941 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 58.76 38.69 24.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.91 0.386 . . . . 0.0 111.057 179.979 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.9 p-10 -83.62 79.74 9.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.892 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -137.43 176.11 9.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.94 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.69 152.45 37.51 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.143 -179.905 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 8.1 mt -97.15 -176.67 3.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.785 179.957 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -135.24 155.68 50.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.995 0.426 . . . . 0.0 110.899 -179.979 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.418 ' C ' ' H ' ' A' ' 53' ' ' TRP . . . 60.4 106.35 0.01 OUTLIER Glycine 0 CA--C 1.508 -0.387 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.704 179.951 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.53 -46.77 0.59 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.63 0.252 . . . . 0.0 111.074 179.939 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.418 ' H ' ' C ' ' A' ' 51' ' ' GLY . 62.3 m95 -99.63 33.33 2.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.823 0.344 . . . . 0.0 111.018 -179.881 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.44 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -71.63 -50.83 9.88 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.899 -179.948 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.44 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 14.1 Cg_exo -68.74 -7.08 19.55 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.639 2.226 . . . . 0.0 112.43 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.408 ' CD2' ' HG ' ' A' ' 79' ' ' LEU . 69.5 m-85 -102.2 178.3 4.64 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.949 0.404 . . . . 0.0 111.071 -179.785 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.47 144.64 42.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.726 -179.984 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -107.18 168.57 9.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.998 -179.944 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 15.0 t -168.33 123.8 0.98 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.896 179.878 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 9.1 m170 -93.28 93.17 8.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.97 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.4 mp -60.1 -31.56 48.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.861 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.43 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 6.1 mtpp -145.89 172.5 5.21 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.622 -179.932 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.43 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 17.4 Cg_exo -66.38 -4.29 10.39 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.672 2.248 . . . . 0.0 112.856 -179.888 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -142.02 29.07 1.68 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.861 179.792 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.2 t -149.39 143.29 18.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.257 -180.0 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -159.13 118.71 3.03 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.683 179.961 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.48 136.69 54.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.85 0.357 . . . . 0.0 110.968 -179.934 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 57.1 t -91.53 137.13 22.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.894 -179.958 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -135.49 172.95 12.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.858 179.934 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.406 HD13 ' CD2' ' A' ' 56' ' ' PHE . 5.0 tp -117.23 162.23 18.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.905 -179.971 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.6 t -106.03 113.38 42.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.12 179.967 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -109.28 159.82 16.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.89 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -58.6 106.44 0.4 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.9 179.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.5 t70 57.4 26.59 12.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.101 -179.809 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -157.78 148.7 21.13 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.855 -179.988 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.6 tp -120.72 138.12 54.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.834 179.974 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.2 pp -124.84 135.61 63.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.198 -179.96 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 58.4 mt -80.04 142.78 34.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.735 179.789 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.408 ' HG ' ' CD2' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -103.89 -71.69 0.72 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.06 -179.789 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.91 161.07 40.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.882 0.373 . . . . 0.0 111.349 -179.841 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.417 ' HB2' ' CE1' ' A' ' 10' ' ' PHE . 1.7 tm? -123.73 133.44 53.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.635 179.911 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -155.03 -176.95 27.82 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.572 179.987 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.7 t -121.5 172.31 8.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.803 0.335 . . . . 0.0 110.936 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -60.06 -28.41 67.77 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.873 179.988 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 49.3 p -82.86 -21.62 34.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.157 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.68 -66.81 0.86 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.809 0.338 . . . . 0.0 111.015 -179.827 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.7 mp -57.69 -37.15 72.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.084 -179.818 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.86 -179.934 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.2 mmm . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.849 0.357 . . . . 0.0 111.171 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 6.6 mt 59.95 167.71 0.07 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.964 179.981 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.89 150.54 45.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.863 179.875 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 7.6 tt -119.51 150.16 40.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.971 179.957 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -136.47 170.38 16.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.918 179.989 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 39.4 mt -131.18 117.76 19.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.798 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -87.61 165.68 15.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.947 179.911 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.0 mttt -66.89 -40.12 87.67 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.83 -179.973 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.9 t -58.96 -35.77 73.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.965 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 39.7 t80 -61.42 -30.16 70.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.008 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -75.95 -33.98 59.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.92 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.434 ' O ' ' CB ' ' A' ' 16' ' ' LYS . 60.6 mttt -89.98 -14.16 34.6 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.199 179.853 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.456 ' O ' ' CB ' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -90.31 -21.18 22.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.971 0.415 . . . . 0.0 110.434 179.394 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.511 ' O ' HD13 ' A' ' 18' ' ' LEU . 40.8 t80 -91.4 -74.65 0.5 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.951 179.461 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.513 ' HA ' HD13 ' A' ' 18' ' ' LEU . 0.2 OUTLIER -51.07 -47.99 61.69 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.781 -179.967 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.434 ' CB ' ' O ' ' A' ' 12' ' ' LYS . 1.6 tppt? -71.87 -13.3 61.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.69 -179.455 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.458 ' HG ' ' CB ' ' A' ' 22' ' ' PHE . 28.3 tp -90.64 -51.31 5.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.933 0.397 . . . . 0.0 110.348 179.837 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.513 HD13 ' HA ' ' A' ' 15' ' ' ASP . 0.4 OUTLIER -55.76 -34.63 65.38 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.344 -179.904 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.0 pp -80.81 -10.7 59.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.224 179.874 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.12 23.14 6.79 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.732 0.301 . . . . 0.0 111.203 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.73 42.36 7.78 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.725 179.806 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.458 ' CB ' ' HG ' ' A' ' 17' ' ' LEU . 89.2 t80 -114.5 122.49 46.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.823 0.344 . . . . 0.0 110.879 179.814 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -61.32 103.39 0.3 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.838 -179.979 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -64.01 -24.42 67.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.128 -179.914 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.2 m -61.68 -47.52 84.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.236 -179.77 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 39.9 t -56.03 -43.89 76.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.313 -179.682 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.418 ' CD2' HD21 ' A' ' 18' ' ' LEU . 0.4 OUTLIER -59.83 -30.4 68.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.825 -179.963 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -53.45 -32.01 48.05 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.677 179.835 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -75.71 -20.24 58.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.865 179.677 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 87.0 t -90.52 -74.0 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.761 -179.695 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.6 mp -44.11 -45.53 2.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.452 -178.985 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.445 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -58.92 -16.69 18.91 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.864 -0.334 . . . . 0.0 111.531 -179.453 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.428 ' N ' HD21 ' A' ' 32' ' ' LEU . 65.2 m -90.0 -27.63 19.63 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 120.79 0.328 . . . . 0.0 110.785 179.689 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 30.1 mt -85.92 -33.42 21.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.241 -179.728 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.0 mtm180 -94.69 20.28 8.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.4 -179.74 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.445 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.1 OUTLIER -122.72 22.3 9.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.374 -179.867 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.434 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 0.6 OUTLIER 45.38 45.83 10.22 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.293 -179.946 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -117.46 127.97 26.32 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.798 -179.992 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.51 154.58 55.31 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.436 2.09 . . . . 0.0 112.257 -179.983 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.5 mp -102.46 146.32 28.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.92 179.972 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -66.79 158.58 79.48 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.922 179.918 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.51 -29.05 53.26 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.51 2.14 . . . . 0.0 112.18 179.949 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.36 -20.42 62.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.062 179.966 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.434 ' CE2' ' HA ' ' A' ' 61' ' ' ILE . 4.0 m-85 -61.3 -23.52 65.76 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.035 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 62.05 42.19 10.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.955 -179.991 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -75.54 84.08 2.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.845 179.932 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -134.02 -168.67 2.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.87 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -84.33 138.29 32.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.251 179.931 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.0 mp -76.75 -174.15 2.91 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.837 179.966 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.4 mttm -125.23 153.71 42.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.879 179.962 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 96.32 -113.71 4.74 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.644 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.1 -19.56 20.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.602 0.239 . . . . 0.0 111.15 -179.871 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 36.3 m95 -96.37 30.64 2.46 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.87 0.367 . . . . 0.0 110.945 -179.963 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.521 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 2.6 mtpt -69.48 -54.77 10.49 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.536 -179.874 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.521 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 21.7 Cg_endo -61.37 -10.42 15.89 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.293 1.995 . . . . 0.0 112.788 -179.799 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.422 ' CD1' HD21 ' A' ' 79' ' ' LEU . 47.4 m-85 -104.75 172.31 6.86 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.874 0.368 . . . . 0.0 110.918 179.818 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.3 ttm180 -120.31 158.29 27.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.783 -179.813 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -123.95 162.96 22.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.036 -179.92 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.1 t -154.97 112.24 3.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.754 179.933 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 9.1 m170 -86.02 71.16 10.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 -179.88 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.434 ' HA ' ' CE2' ' A' ' 44' ' ' PHE . 3.8 mp -59.08 -27.14 35.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.07 179.818 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.425 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 3.3 mttp -148.73 164.77 20.02 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.637 -179.804 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.425 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 42.0 Cg_endo -67.4 -3.22 9.65 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.447 2.098 . . . . 0.0 112.848 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -139.19 26.71 2.39 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.675 179.708 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 52.1 t -143.42 146.16 21.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.264 -179.909 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.7 mt -147.95 96.58 2.67 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.718 179.855 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -84.51 134.87 34.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.01 -179.986 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 94.7 t -106.83 119.83 57.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.399 179.261 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -136.13 178.32 7.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.062 -179.498 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.2 tp -130.29 168.5 16.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.914 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -120.47 110.01 27.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.117 -179.981 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.87 176.48 5.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.778 179.986 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -59.78 103.16 0.19 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.905 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 55.89 24.52 7.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.119 -179.855 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -149.61 153.56 37.26 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.91 -179.957 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.0 tt -123.88 144.14 49.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.684 179.853 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.5 pp -129.33 138.05 55.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.315 -179.788 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 89.6 mt -86.58 131.46 34.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.553 179.625 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.422 HD21 ' CD1' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -91.78 -74.17 0.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.104 -179.607 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.75 177.68 11.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.874 0.369 . . . . 0.0 111.345 -179.845 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -119.2 134.76 55.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.93 -179.885 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -140.61 -173.18 13.3 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.538 179.961 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.9 m -144.58 171.07 14.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.867 0.365 . . . . 0.0 110.99 -179.968 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -59.68 -28.45 67.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.95 179.91 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.2 m -87.83 -26.31 22.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.087 -179.985 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -80.67 -70.21 0.54 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.912 -179.932 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.25 -38.29 75.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.01 -179.908 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.919 179.984 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.813 0.34 . . . . 0.0 111.217 . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.5 mt 60.8 160.86 0.05 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.015 179.832 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.12 150.72 28.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.851 179.927 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 tt -116.06 147.5 41.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.916 179.996 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -133.9 -178.39 5.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.943 179.945 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.3 mt -142.82 112.14 6.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.874 -179.93 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.2 mmtp -85.61 161.63 19.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.88 -179.997 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 17.4 mmtm -62.06 -30.85 71.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.951 179.969 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.0 t -72.15 -33.27 67.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.98 179.929 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -73.97 -31.1 62.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.904 -179.936 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -65.39 -40.72 93.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.929 179.977 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.406 ' O ' ' CB ' ' A' ' 16' ' ' LYS . 17.5 mttt -88.63 -11.17 46.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.317 179.962 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -90.44 -26.21 19.96 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.828 0.347 . . . . 0.0 110.415 179.516 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.436 ' O ' HD11 ' A' ' 18' ' ' LEU . 66.4 t80 -91.09 -70.71 0.67 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.177 179.866 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -62.6 -52.47 63.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.833 -179.197 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.406 ' CB ' ' O ' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -62.41 -17.68 59.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.62 -179.279 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.415 HD22 ' CD2' ' A' ' 22' ' ' PHE . 44.9 tp -90.23 -40.94 11.87 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.075 0.464 . . . . 0.0 110.34 179.566 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.538 ' N ' HD11 ' A' ' 18' ' ' LEU . 0.0 OUTLIER -48.86 -45.26 40.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.192 -179.705 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.1 mt -90.06 0.79 56.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.802 -179.482 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -97.92 30.79 2.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.853 0.359 . . . . 0.0 111.003 -179.984 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 92.38 22.86 28.19 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.685 179.929 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.523 ' CD1' HD12 ' A' ' 18' ' ' LEU . 30.2 t80 -110.08 127.06 54.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.843 0.354 . . . . 0.0 110.704 179.845 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -68.09 110.35 3.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.888 -179.979 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -61.71 -19.46 62.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.222 179.836 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.66 -20.91 66.09 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.273 179.987 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.8 t -82.1 -40.2 17.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.426 -179.752 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 pp -56.6 -36.56 69.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.965 -179.777 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -63.23 -16.2 59.47 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.408 -179.97 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.418 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 57.2 mt-10 -90.12 -35.27 15.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.837 0.351 . . . . 0.0 111.218 -179.716 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.8 p -90.5 -32.2 5.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.367 -0.379 . . . . 0.0 112.002 -179.589 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.7 mp -76.49 -48.86 25.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.578 -179.446 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.418 ' CD2' ' O ' ' A' ' 29' ' ' GLU . 0.7 OUTLIER -56.96 -22.43 37.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.683 0.278 . . . . 0.0 111.189 -179.752 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 93.5 m -82.68 -28.93 30.29 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.878 0.371 . . . . 0.0 110.808 179.66 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 12.6 mt -90.12 -23.04 21.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.731 -179.421 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -104.16 20.24 18.67 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -179.176 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.466 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 7.4 mtmt -118.37 -55.85 2.19 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.211 179.79 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.466 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 10.1 pttm 156.29 -20.54 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.035 179.665 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -61.86 111.27 4.2 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.072 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -68.64 163.86 35.35 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.412 2.075 . . . . 0.0 112.117 179.8 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.2 mt -86.44 123.42 31.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.064 179.977 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -61.6 157.26 48.74 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.947 -179.871 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.77 -30.56 49.89 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.616 2.21 . . . . 0.0 112.294 179.875 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.79 -19.47 59.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.01 179.822 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.427 ' CE2' ' HA ' ' A' ' 61' ' ' ILE . 3.1 m-85 -62.69 -16.52 57.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.217 179.983 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 67.44 52.06 0.82 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.923 0.392 . . . . 0.0 110.952 -179.862 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.6 p-10 -88.28 107.69 18.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.787 179.902 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.96 -168.29 3.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.855 -179.965 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -90.8 126.89 36.15 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.143 179.855 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.5 mp -64.48 169.01 5.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.895 179.93 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.42 167.75 10.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.09 179.948 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.27 -126.3 7.32 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.559 -179.94 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.03 -5.22 55.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.639 0.257 . . . . 0.0 111.37 179.965 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 6.0 m0 -97.65 29.31 3.39 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.89 0.376 . . . . 0.0 110.966 179.949 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.516 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -66.83 -56.2 14.9 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.407 -179.871 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.516 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 19.0 Cg_endo -59.2 -12.65 16.74 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.343 2.029 . . . . 0.0 112.572 -179.994 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -93.71 170.12 9.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.841 0.353 . . . . 0.0 110.865 179.949 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.78 132.95 44.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.793 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -104.76 170.01 8.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.971 -179.961 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 16.3 t -164.94 122.45 1.6 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.764 -179.981 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 10.4 m170 -93.02 84.22 4.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.068 -179.826 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.427 ' HA ' ' CE2' ' A' ' 44' ' ' PHE . 3.6 mp -64.82 -49.58 79.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.041 0.448 . . . . 0.0 110.811 179.714 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.487 ' HB2' ' CG2' ' A' ' 65' ' ' VAL . 0.1 OUTLIER -111.03 174.11 2.52 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.476 -179.851 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.415 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 12.9 Cg_exo -69.1 -5.82 16.74 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.617 2.211 . . . . 0.0 112.78 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -150.19 34.18 0.65 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.782 179.941 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.487 ' CG2' ' HB2' ' A' ' 62' ' ' LYS . 88.5 t -133.7 142.68 40.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.94 -179.835 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -145.97 98.81 3.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.876 179.97 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -97.65 113.39 25.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.552 179.983 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 60.9 t -85.24 138.07 19.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.255 -179.835 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 31.4 p90 -143.8 147.14 33.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.863 179.781 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.28 157.36 17.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.871 -179.892 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.6 t -107.81 109.92 30.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.25 -179.929 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.66 165.97 19.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.623 179.8 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -41.88 -32.73 0.44 Allowed 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.378 -179.811 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -163.43 29.9 0.09 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.805 179.757 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -150.0 162.02 41.19 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.7 -179.864 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.2 tp -117.13 137.23 52.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.93 0.395 . . . . 0.0 110.66 179.706 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.4 pp -128.16 137.75 56.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.245 -179.849 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 80.0 mt -84.24 119.93 25.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.738 179.788 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.444 ' HB3' ' HD3' ' A' ' 80' ' ' ARG . 0.2 OUTLIER -78.32 -68.86 0.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.901 -179.925 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.444 ' HD3' ' HB3' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -163.04 170.26 18.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.917 0.389 . . . . 0.0 111.355 179.826 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -126.91 134.19 50.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.662 179.96 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -160.39 -168.83 22.87 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.554 179.985 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.1 m -123.85 178.12 5.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.914 0.388 . . . . 0.0 110.732 -179.93 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -60.7 -29.3 69.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.001 -179.857 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.1 t -85.62 -30.43 23.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.035 -179.882 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.53 -71.68 0.4 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.898 -179.827 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.4 -33.36 75.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.867 179.999 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.811 -179.96 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 120.734 0.302 . . . . 0.0 111.166 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.2 mt -137.45 163.75 30.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.904 179.978 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.83 165.61 3.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.818 179.969 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.6 tt -133.95 153.8 51.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.996 -179.919 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -138.19 -178.11 5.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.806 -179.993 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 15.4 mt -146.14 133.37 20.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.976 -179.956 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.82 164.34 11.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.796 179.968 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.4 -31.73 72.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.93 -179.96 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.6 p -70.29 -37.31 74.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.92 179.988 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -59.2 -49.74 76.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.894 -179.948 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -64.03 -44.36 92.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.916 -179.995 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.0 mmtt -74.37 -7.67 53.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.526 179.968 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.28 -31.76 16.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.767 0.317 . . . . 0.0 110.962 -179.913 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.461 ' CD2' HD22 ' A' ' 18' ' ' LEU . 0.1 OUTLIER -90.21 -54.9 3.82 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.344 179.944 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -49.46 -32.37 11.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.769 179.474 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.57 -22.35 26.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.86 179.62 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 mt -83.77 -49.54 8.99 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 120.943 0.401 . . . . 0.0 110.264 179.682 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.461 HD22 ' CD2' ' A' ' 14' ' ' PHE . 4.3 mm? -47.26 -40.51 16.74 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.398 179.957 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.5 mt -89.54 -0.49 57.54 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.899 -179.405 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -98.52 33.49 2.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.804 0.335 . . . . 0.0 110.782 -179.887 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.66 23.53 53.04 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.331 -179.924 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.413 ' CD1' ' O ' ' A' ' 23' ' ' ASP . 26.4 t80 -107.1 115.84 30.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.809 0.338 . . . . 0.0 110.675 -179.868 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.413 ' O ' ' CD1' ' A' ' 22' ' ' PHE . 5.9 t70 -55.1 146.25 18.85 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.193 -179.742 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -96.52 -29.22 14.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.048 -179.988 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.1 m -57.62 -40.61 79.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.112 -179.861 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 12.2 p -74.62 -26.85 20.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.332 -179.999 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.71 -39.98 86.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.829 0.347 . . . . 0.0 110.901 -179.957 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.466 ' O ' ' HB3' ' A' ' 32' ' ' LEU . 32.1 t-20 -50.27 -57.62 7.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.025 -179.759 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -51.77 -19.83 1.85 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.744 179.952 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 76.6 t -88.94 -74.36 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.836 0.351 . . . . 0.0 111.746 -179.452 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.7 mp -50.77 -45.39 27.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.15 -0.477 . . . . 0.0 112.011 -178.982 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.466 ' HB3' ' O ' ' A' ' 28' ' ' ASN . 0.0 OUTLIER -57.05 -34.61 68.41 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 121.001 -0.28 . . . . 0.0 111.061 -179.498 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.444 ' N ' ' CD2' ' A' ' 32' ' ' LEU . 90.2 m -68.68 -27.11 65.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.796 0.331 . . . . 0.0 110.875 179.88 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 46.7 mt -90.06 -25.73 20.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.414 -179.719 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 20.4 mtp180 -104.17 20.12 18.9 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.278 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.507 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -115.62 -55.85 2.4 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.168 179.886 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.507 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 151.15 -20.43 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.996 0.518 . . . . 0.0 110.882 179.74 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.39 120.6 41.44 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.085 -179.638 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -72.49 -179.34 4.0 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.342 2.028 . . . . 0.0 112.135 179.882 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -123.2 129.28 51.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.84 179.958 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.406 ' HB2' ' CE1' ' A' ' 44' ' ' PHE . 1.9 m-20 -57.41 159.26 9.12 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.115 -179.887 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.75 -10.06 27.0 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.552 2.168 . . . . 0.0 112.471 -179.98 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.33 9.47 23.17 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.339 179.857 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.406 ' CE1' ' HB2' ' A' ' 41' ' ' ASP . 4.1 m-85 -89.43 8.42 30.94 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.292 179.864 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.404 ' HB2' ' CD2' ' A' ' 60' ' ' HIS . 1.2 mp0 60.31 40.0 18.2 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.824 0.345 . . . . 0.0 110.9 179.882 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -82.06 73.08 9.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.844 179.963 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -129.49 172.35 11.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.857 179.947 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -81.62 133.7 35.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.071 -179.946 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 15.4 mt -82.37 176.14 9.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.857 -179.993 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.7 mtpt -114.29 175.66 5.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.924 179.968 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.38 -128.78 13.71 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.5 -179.929 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.1 mmtt -67.98 -26.39 65.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.591 0.234 . . . . 0.0 110.889 179.995 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 5.6 m-90 -97.59 39.38 1.21 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.832 0.349 . . . . 0.0 110.887 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.437 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -75.35 -51.04 3.45 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.205 179.971 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.437 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 71.9 Cg_endo -77.73 3.52 6.84 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.32 2.013 . . . . 0.0 112.671 -179.988 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -114.21 169.31 9.12 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.796 0.331 . . . . 0.0 110.89 179.904 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.412 ' HG2' ' CZ ' ' A' ' 69' ' ' TYR . 1.0 OUTLIER -128.58 145.22 51.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.947 -179.987 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -102.75 165.78 10.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.909 179.946 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -162.31 116.72 1.83 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.855 179.938 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.416 ' CD2' ' N ' ' A' ' 60' ' ' HIS . 5.0 m170 -90.68 85.88 6.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.986 179.978 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.3 mp -59.8 -29.17 42.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.021 -179.978 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.403 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 4.7 mtpt -142.61 168.34 13.61 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.77 -179.911 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.403 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 20.3 Cg_exo -65.43 -6.71 14.09 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.643 2.229 . . . . 0.0 112.743 -179.916 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -138.64 25.95 2.57 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.86 179.789 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 67.5 t -140.78 140.83 32.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.218 179.945 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -157.31 114.86 3.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.485 179.974 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.23 139.43 53.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.039 -179.881 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 39.2 t -88.69 147.0 5.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.794 179.841 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.412 ' CZ ' ' HG2' ' A' ' 57' ' ' ARG . 9.0 p90 -148.99 161.08 42.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.115 -179.974 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -116.06 156.69 25.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.828 179.958 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.3 t -107.33 99.75 9.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.184 179.951 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.76 170.72 13.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.781 179.947 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -60.43 104.25 0.31 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.809 179.945 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 57.17 20.98 6.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.139 -179.843 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -149.55 138.51 21.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.639 -179.982 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.37 148.33 24.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.867 179.699 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.9 pp -139.32 130.8 34.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.331 -179.87 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 80.0 mt -74.96 148.21 40.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.511 179.677 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.38 -73.58 0.68 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.273 -179.698 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.02 161.52 42.18 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.989 0.423 . . . . 0.0 111.499 -179.8 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -115.01 131.56 56.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.694 179.881 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -137.17 -177.75 15.32 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.451 179.931 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.7 m -150.72 178.14 9.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.879 0.371 . . . . 0.0 110.893 179.995 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.0 t-80 -64.04 -27.17 68.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.948 -179.998 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.7 m -87.41 -28.26 22.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.945 179.94 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -85.62 -74.82 0.39 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.015 -179.895 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 41.3 mt -62.08 -41.74 98.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.956 -179.909 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.887 179.982 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.7 tpt . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.699 0.285 . . . . 0.0 111.468 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 40.1 mt -110.21 -178.67 3.57 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.845 0.355 . . . . 0.0 110.885 -179.952 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.34 149.17 22.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.884 179.915 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -115.66 148.15 40.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.956 179.912 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -133.46 176.75 8.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.824 179.948 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 54.1 mt -148.98 112.8 5.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.928 179.933 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.3 mmtt -86.89 176.87 7.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.935 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.06 -33.57 68.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.845 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.4 t -67.23 -35.9 80.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.949 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -72.06 -31.15 65.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.877 179.933 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -68.99 -40.45 78.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.843 179.976 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.402 ' O ' ' CB ' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -85.73 -9.49 57.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.336 -179.999 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.507 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 0.7 OUTLIER -90.36 -27.18 19.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.714 0.292 . . . . 0.0 111.008 179.915 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.474 ' CG ' HD11 ' A' ' 18' ' ' LEU . 7.4 t80 -91.23 -69.52 0.73 Allowed 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.334 179.704 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.514 ' HA ' HD13 ' A' ' 18' ' ' LEU . 21.1 t0 -49.19 -50.08 39.69 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.239 179.719 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.402 ' CB ' ' O ' ' A' ' 12' ' ' LYS . 1.5 tpmp? -68.08 -13.52 62.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.205 -179.982 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.507 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 3.9 mt -90.27 -55.09 3.74 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-O 121.189 0.518 . . . . 0.0 110.013 179.503 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.514 HD13 ' HA ' ' A' ' 15' ' ' ASP . 0.5 OUTLIER -54.57 -25.89 28.99 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.379 179.868 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 74.9 mt -90.08 -35.15 15.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.941 179.954 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -62.56 -23.36 66.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.146 -179.968 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.99 42.62 0.16 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.47 -179.946 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -113.44 123.54 50.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.777 0.323 . . . . 0.0 110.724 179.908 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -56.38 103.27 0.1 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.897 179.944 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -54.93 -28.71 53.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.026 -179.962 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.13 -27.05 52.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.095 -179.959 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 35.2 t -72.51 -35.74 52.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.261 -179.88 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.405 ' HG ' ' N ' ' A' ' 28' ' ' ASN . 1.2 pp -58.54 -36.66 74.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.186 -179.625 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.405 ' N ' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -58.42 -19.63 37.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.319 -179.798 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -90.06 -37.69 14.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.388 -179.624 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.409 HG12 ' CD1' ' A' ' 31' ' ' ILE . 14.8 p -90.31 -44.99 14.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 112.162 0.431 . . . . 0.0 112.162 -179.197 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.409 ' CD1' HG12 ' A' ' 30' ' ' VAL . 1.7 mp -62.25 -51.94 66.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.55 0.214 . . . . 0.0 111.408 -179.506 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.9 -37.24 63.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.716 0.293 . . . . 0.0 111.081 -179.576 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 84.8 m -65.88 -37.65 86.71 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.866 0.365 . . . . 0.0 110.598 179.867 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.2 mt -72.82 -30.01 63.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.841 179.924 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.4 mtp180 -102.95 20.13 18.11 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.997 -179.983 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.441 ' O ' ' CG ' ' A' ' 37' ' ' LYS . 2.5 mmmt -116.85 19.38 14.43 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.369 -179.899 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.441 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 3.9 pttp 45.77 39.2 4.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.263 -179.957 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -108.07 111.91 61.78 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.731 -179.922 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -67.3 136.87 41.67 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.419 2.079 . . . . 0.0 112.257 179.961 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 27.0 mt -79.45 179.8 7.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.877 179.984 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -112.23 155.71 43.12 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.932 -179.988 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -67.17 -10.93 30.32 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 122.629 2.219 . . . . 0.0 112.537 179.92 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.96 7.23 25.14 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.417 179.937 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -93.47 14.95 17.08 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.585 0.231 . . . . 0.0 111.121 179.89 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 59.25 38.17 23.43 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.868 0.366 . . . . 0.0 110.972 179.89 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -93.55 112.72 24.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.927 179.945 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 24.8 p-80 -163.36 -175.74 4.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.899 -179.981 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.38 129.58 35.0 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.113 179.97 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.4 mp -74.39 174.63 8.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.829 -179.929 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -102.63 163.58 12.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.895 -179.915 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.25 -137.51 18.51 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.602 -179.92 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.56 -5.07 48.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.649 0.261 . . . . 0.0 111.45 179.965 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 9.5 m0 -97.05 33.2 1.97 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.791 0.329 . . . . 0.0 111.096 -179.955 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.438 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 7.2 tttt -81.44 -51.05 0.89 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.962 179.957 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.438 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 50.2 Cg_exo -55.46 -18.12 18.59 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.425 2.084 . . . . 0.0 112.367 179.749 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.425 ' CG ' HD22 ' A' ' 79' ' ' LEU . 17.1 m-85 -102.1 177.86 4.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.904 0.383 . . . . 0.0 111.012 -179.985 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.7 tpp180 -135.96 139.63 43.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.936 179.984 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -95.95 158.68 15.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.815 179.955 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 2.6 t -160.94 113.41 1.93 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.866 -179.945 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.408 ' CD2' ' N ' ' A' ' 60' ' ' HIS . 3.5 m-70 -97.2 89.46 4.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.981 179.928 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.4 mp -55.08 -27.49 19.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.013 179.762 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.431 ' HB2' ' CD ' ' A' ' 63' ' ' PRO . 0.0 OUTLIER -154.77 170.96 7.76 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.551 179.971 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.431 ' CD ' ' HB2' ' A' ' 62' ' ' LYS . 17.0 Cg_exo -67.0 -0.06 4.33 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.689 2.259 . . . . 0.0 113.164 -179.702 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -134.86 25.21 3.64 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.664 0.268 . . . . 0.0 111.157 179.89 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 58.4 t -155.63 143.63 12.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.004 0.431 . . . . 0.0 111.309 179.913 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -159.13 100.43 1.54 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.693 179.794 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -105.84 151.51 24.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.893 -179.858 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 59.0 t -100.53 139.95 20.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.13 -179.914 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 16.9 p90 -145.66 158.48 43.84 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.924 179.912 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.7 tp -114.08 157.77 22.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.857 179.866 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -113.75 105.34 18.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.206 -179.919 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 10.6 tptt -76.09 165.73 24.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.666 179.815 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -44.53 -31.87 1.24 Allowed 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.363 -179.942 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -160.4 28.79 0.16 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.787 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -148.55 163.51 36.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.654 179.985 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.0 tp -122.52 130.9 53.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.673 179.658 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.1 pp -122.8 133.35 69.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.349 -179.665 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 85.7 mt -82.25 126.61 32.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.637 179.648 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.425 HD22 ' CG ' ' A' ' 56' ' ' PHE . 0.1 OUTLIER -85.38 -66.21 0.92 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.055 -179.783 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.13 165.71 26.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.989 0.423 . . . . 0.0 111.478 -179.945 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -124.7 135.65 53.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.656 -179.913 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -162.3 -172.19 29.42 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.687 179.932 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.92 -167.97 1.96 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.837 0.351 . . . . 0.0 110.878 -179.915 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -73.54 -27.53 61.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.022 -179.964 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.5 t -86.56 -22.69 26.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.221 -180.0 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -87.28 -69.13 0.7 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.853 0.359 . . . . 0.0 111.041 -179.987 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 25.4 mt -59.83 -40.68 89.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.025 -179.959 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.892 179.971 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.859 0.361 . . . . 0.0 111.107 . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 62.1 mt -107.23 158.33 17.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.911 179.994 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.69 156.11 17.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.918 179.997 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.2 tt -120.28 143.75 48.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.842 179.939 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -126.7 178.5 5.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.985 -179.929 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 41.0 mt -144.18 123.12 12.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.899 179.965 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.3 mmmt -97.05 174.42 6.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.978 -179.924 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.06 -46.53 80.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.802 179.911 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 t -58.06 -24.11 57.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.934 179.831 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.489 ' HA ' ' OD2' ' A' ' 13' ' ' ASP . 32.9 t80 -84.23 -26.59 28.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.034 179.976 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -69.51 -28.03 65.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.204 -179.782 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.463 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -90.04 -7.47 53.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.781 -179.745 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.489 ' OD2' ' HA ' ' A' ' 10' ' ' PHE . 18.4 p30 -90.6 -15.97 29.57 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.894 0.378 . . . . 0.0 111.57 -179.811 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.542 ' O ' ' CD1' ' A' ' 18' ' ' LEU . 8.8 t80 -90.86 -60.21 1.97 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.228 -178.994 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.443 ' HA ' HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -91.6 -41.0 11.01 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.374 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.463 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 2.0 mptm? -69.99 -40.08 75.53 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -178.839 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.39 -29.39 67.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.929 0.395 . . . . 0.0 110.214 179.698 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.544 HD12 ' CD1' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -62.47 -24.1 67.27 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.116 179.856 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.2 15.11 10.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.393 -179.885 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -123.87 45.0 2.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.818 0.342 . . . . 0.0 110.885 179.873 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 71.21 28.89 69.32 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.328 -179.946 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.544 ' CD1' HD12 ' A' ' 18' ' ' LEU . 8.9 t80 -113.18 140.58 47.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.854 0.359 . . . . 0.0 110.783 -179.93 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.419 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 4.3 t0 -97.49 117.9 32.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.902 179.987 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -59.73 -28.73 67.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.237 -179.923 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 25.1 p -54.96 -23.31 18.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.542 -179.83 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.6 t -87.38 -42.71 15.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.765 0.317 . . . . 0.0 111.384 -179.726 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.455 ' CD1' ' CE2' ' A' ' 14' ' ' PHE . 0.4 OUTLIER -59.25 -32.27 69.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.01 -179.833 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -53.51 -31.2 45.07 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.875 -179.986 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -81.63 -23.35 37.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.824 179.696 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 96.2 t -78.08 -73.1 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.023 -179.973 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.6 mp -47.45 -33.57 3.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.865 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.406 ' CD2' ' N ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -58.86 -55.18 38.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.565 179.72 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.406 ' N ' ' CD2' ' A' ' 32' ' ' LEU . 99.2 m -58.53 -34.76 71.35 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.945 -179.943 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.0 mt -66.75 -46.79 74.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.841 -179.978 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -96.04 20.15 10.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.084 179.994 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.8 mmtt -97.37 12.67 32.33 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.398 -179.905 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.4 mtmt 61.94 27.42 16.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.778 0.323 . . . . 0.0 110.832 179.964 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.25 123.72 29.17 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.863 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -74.31 150.22 41.44 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.361 2.04 . . . . 0.0 112.379 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.8 mt -88.27 128.05 35.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.818 179.996 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.26 158.22 88.07 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.066 -179.953 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.66 -10.33 28.36 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.526 2.15 . . . . 0.0 112.455 179.857 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.1 5.86 27.97 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.316 179.817 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -93.69 17.28 12.12 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-O 120.662 0.267 . . . . 0.0 111.183 179.872 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.41 ' HB2' ' CG ' ' A' ' 60' ' ' HIS . 45.0 mm-40 63.98 30.29 14.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.087 179.882 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -88.68 87.92 7.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.906 -179.962 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 17.8 p-80 -143.45 176.37 9.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.873 179.992 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.26 140.29 46.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.101 -179.959 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.4 mt -89.7 174.17 7.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.946 179.884 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.0 mtpm? -109.34 164.6 12.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.946 179.981 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.76 -140.91 22.18 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.513 179.989 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.2 tmtt? -74.02 -8.53 56.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.598 0.237 . . . . 0.0 111.352 -179.974 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 19.7 m-90 -96.51 26.39 4.45 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.762 0.315 . . . . 0.0 111.197 -179.942 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.461 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.2 OUTLIER -74.54 -49.52 4.92 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.002 179.911 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.461 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 43.6 Cg_exo -56.45 -17.65 22.37 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.4 2.067 . . . . 0.0 112.437 179.779 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -110.27 174.45 5.86 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.004 -179.87 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -131.13 154.52 48.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.813 179.923 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -105.03 170.14 8.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.931 -179.928 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 3.5 t -168.5 116.88 0.7 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.738 179.997 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.422 ' CD2' HD22 ' A' ' 66' ' ' LEU . 11.1 m170 -95.32 89.08 5.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.993 -179.938 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.2 mp -66.25 -29.88 48.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.903 179.778 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.4 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 16.8 mttt -136.68 171.79 8.08 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.78 179.966 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.4 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 14.8 Cg_exo -68.18 -3.12 10.14 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.663 2.242 . . . . 0.0 112.906 -179.984 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -147.23 30.39 0.94 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.785 179.82 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 58.8 t -138.37 144.13 31.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.277 179.88 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.422 HD22 ' CD2' ' A' ' 60' ' ' HIS . 0.6 OUTLIER -149.8 108.44 3.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.771 -179.975 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -108.69 133.54 52.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.001 0.429 . . . . 0.0 110.989 -179.957 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 97.4 t -94.7 140.96 15.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.724 179.751 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -146.06 168.48 20.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.905 179.945 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.64 -178.01 4.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.95 -179.822 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.7 t -128.27 115.81 39.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.075 179.871 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -99.51 -178.42 3.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.862 179.99 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -66.28 103.54 1.03 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.854 -179.898 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 56.82 22.73 7.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.14 179.984 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -155.28 136.34 13.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.819 -179.975 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.5 tp -93.93 154.4 17.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.878 -179.992 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.9 pp -138.27 132.92 42.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.266 -179.94 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.425 HD11 ' CZ ' ' A' ' 10' ' ' PHE . 55.4 mt -81.33 142.06 33.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.566 179.686 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.71 -71.12 0.71 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.279 -179.63 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.36 161.08 39.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.011 0.434 . . . . 0.0 111.498 -179.587 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.451 ' N ' ' OD2' ' A' ' 13' ' ' ASP . 3.2 tm? -112.51 125.33 54.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.566 179.94 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -136.27 -161.91 9.31 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.66 -179.918 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.4 p -150.57 -177.75 6.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.904 0.383 . . . . 0.0 110.846 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -66.77 -27.98 68.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.995 179.991 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -87.36 -24.97 24.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.193 -179.96 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.15 -73.63 0.43 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.897 -179.888 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 23.3 mt -61.32 -41.08 96.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.93 -179.96 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.213 -0.898 . . . . 0.0 110.868 -179.952 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 120.717 0.294 . . . . 0.0 111.485 . . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 mt -83.11 -175.79 6.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.915 0.388 . . . . 0.0 110.84 179.995 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.79 155.91 12.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.836 179.98 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.79 147.46 46.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.993 -179.936 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -133.33 177.62 7.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.849 179.91 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.8 mp -143.48 132.55 22.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.969 179.968 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 30.1 mmtm -107.39 158.91 16.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.806 180.0 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.3 mttp -61.77 -32.67 72.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.765 179.955 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 88.8 p -63.57 -23.31 67.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.153 179.925 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -78.14 -32.07 50.16 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.085 -179.811 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -70.06 -47.88 60.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.128 -179.905 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.455 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -75.21 -6.49 49.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.556 -179.959 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.53 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -90.83 -22.6 20.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.976 179.937 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.456 ' CE2' HD22 ' A' ' 18' ' ' LEU . 43.6 t80 -90.81 -70.85 0.66 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.552 -179.74 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -49.72 -35.81 23.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.212 -179.871 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 4.5 tppt? -76.57 -20.89 56.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.981 179.88 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.53 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 1.6 mt -89.61 -52.21 5.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.951 0.405 . . . . 0.0 110.151 179.187 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.456 HD22 ' CE2' ' A' ' 14' ' ' PHE . 4.3 mm? -49.2 -32.43 10.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.536 -179.771 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.4 pp -89.65 -8.22 52.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.708 -179.629 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -96.6 40.11 1.14 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.846 0.355 . . . . 0.0 110.846 -179.954 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 70.01 27.6 72.82 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.495 -179.936 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -95.35 128.14 41.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.827 0.346 . . . . 0.0 110.81 -179.95 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.98 119.6 6.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.915 -179.97 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -82.59 -34.84 27.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.157 -179.796 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.68 -22.62 47.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.257 -179.929 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.3 t -82.48 -35.06 12.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.392 -179.871 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -56.98 -36.45 70.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.107 -179.69 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -62.77 -23.36 67.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.269 -179.798 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -80.04 -33.82 38.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.138 -179.814 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.426 HG13 ' CD1' ' A' ' 31' ' ' ILE . 11.7 p -89.96 -43.3 14.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.262 -179.879 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.426 ' CD1' HG13 ' A' ' 30' ' ' VAL . 1.5 mp -64.75 -24.7 36.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.871 179.853 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -70.84 -46.85 61.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.15 -179.844 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.8 m -62.81 -25.98 68.51 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.42 -179.473 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.0 mt -90.04 -35.72 15.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.73 0.3 . . . . 0.0 111.544 -179.478 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.17 20.23 7.14 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.335 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.472 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 3.2 mttm -118.43 -55.96 2.18 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.054 179.724 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.472 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 2.3 pttt 154.65 -20.41 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.0 179.565 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.31 120.72 70.02 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.163 -179.627 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.51 -178.74 4.7 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.476 2.118 . . . . 0.0 112.289 179.832 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 59.3 mt -92.31 108.66 20.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.929 179.843 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -58.74 161.6 8.16 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.98 -179.927 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -67.14 -33.25 31.93 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.461 2.107 . . . . 0.0 112.189 179.915 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -58.9 -21.07 56.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.106 179.854 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.425 ' CE2' ' HA ' ' A' ' 61' ' ' ILE . 3.5 m-85 -57.42 -21.78 38.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.136 179.961 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 64.44 66.57 0.6 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.988 0.423 . . . . 0.0 110.963 179.999 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -93.29 106.17 18.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.861 179.911 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 42.1 m80 -124.2 175.5 7.0 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.929 179.972 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -99.31 114.55 27.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.132 -179.967 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.3 mt -61.56 159.13 13.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.837 179.989 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.66 165.74 11.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.107 -179.928 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.426 ' C ' ' H ' ' A' ' 53' ' ' TRP . . . 58.39 108.21 0.01 OUTLIER Glycine 0 CA--C 1.507 -0.429 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.809 179.754 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.4 mptt 69.14 -46.15 0.56 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.628 0.252 . . . . 0.0 111.161 179.815 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.426 ' H ' ' C ' ' A' ' 51' ' ' GLY . 22.6 m95 -97.03 32.14 2.22 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.994 -179.894 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.419 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.2 OUTLIER -69.3 -51.86 16.47 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.087 179.891 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 98.9 Cg_endo -80.21 46.24 2.19 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.437 2.091 . . . . 0.0 112.522 179.933 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -156.52 175.66 13.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.852 0.358 . . . . 0.0 110.88 179.849 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 14.7 ttm105 -137.79 144.04 41.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.919 -179.942 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -105.35 177.31 4.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.975 -179.895 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -168.26 126.09 1.12 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.68 -179.992 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.442 ' CD2' ' N ' ' A' ' 60' ' ' HIS . 2.6 m-70 -102.19 82.69 2.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.07 -179.734 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.432 ' CD1' ' HB3' ' A' ' 67' ' ' LEU . 4.4 mp -59.99 -26.94 37.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.771 179.662 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.419 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 23.5 mtpp -139.82 169.25 12.51 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.566 179.927 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.419 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 12.2 Cg_exo -70.04 -0.19 6.78 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.802 2.335 . . . . 0.0 112.983 -179.86 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -143.33 27.61 1.55 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.875 179.877 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 38.9 t -139.51 152.06 22.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.938 0.399 . . . . 0.0 111.311 179.992 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -148.17 100.54 3.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.552 179.804 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.432 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 4.2 tp -97.48 131.32 44.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.059 -179.679 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 57.1 t -106.14 136.75 39.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.891 179.793 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.408 ' CE1' HD11 ' A' ' 76' ' ' LEU . 45.3 p90 -153.55 164.04 38.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.136 -179.921 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.4 tp -106.39 174.46 5.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.864 179.916 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.4 t -123.86 123.23 66.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.26 -179.957 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 3.7 tptp -100.15 160.97 13.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.743 179.919 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -44.27 -49.46 9.35 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.54 -179.81 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -137.89 28.3 2.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.919 179.927 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 50.6 mp0 -156.88 170.0 23.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.824 179.96 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.408 HD11 ' CE1' ' A' ' 69' ' ' TYR . 0.7 OUTLIER -129.88 141.15 50.85 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.682 179.803 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.3 pp -128.95 131.55 68.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.396 -179.724 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 72.5 mt -73.43 158.44 34.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.599 179.77 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.84 -78.33 0.58 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.045 -179.885 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.72 167.06 29.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.013 0.435 . . . . 0.0 111.253 -179.909 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -114.19 137.72 51.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.696 179.849 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -141.26 -176.32 15.52 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.675 -179.775 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -140.88 -176.15 4.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.812 0.339 . . . . 0.0 110.895 179.985 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -67.75 -27.78 67.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.167 -179.949 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.2 m -90.02 -27.57 19.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.099 -179.97 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -80.18 -75.11 0.27 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.842 0.353 . . . . 0.0 111.015 -179.798 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 29.6 mt -67.17 -38.43 85.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.023 -179.943 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.192 -0.908 . . . . 0.0 111.027 179.92 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.819 0.343 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 10.3 mt -96.34 161.95 13.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.92 179.905 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -66.56 160.89 24.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.819 179.987 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.9 tt -128.64 144.96 51.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.905 179.781 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -141.48 163.33 33.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.859 -179.925 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.6 mp -124.63 125.55 44.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.858 179.998 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 58.8 mmtt -92.12 168.86 11.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.942 -179.969 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -60.33 -32.23 71.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.782 -179.97 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.3 m -70.83 -47.49 59.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.821 179.936 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.414 ' CE1' HD12 ' A' ' 67' ' ' LEU . 31.3 t80 -63.86 -30.7 71.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.959 -179.833 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -63.23 -46.16 88.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.996 -179.916 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.477 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 7.4 pttt -87.08 -5.6 58.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.597 -179.955 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.401 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -90.77 -15.74 29.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.082 179.778 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.442 ' O ' ' CD1' ' A' ' 18' ' ' LEU . 21.1 t80 -90.82 -74.33 0.5 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.633 -179.474 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -79.65 -32.93 41.65 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -178.899 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.477 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.4 OUTLIER -75.41 -16.57 60.34 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.213 -179.656 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.401 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 32.7 tp -90.14 -37.41 14.22 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.402 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.535 ' N ' HD13 ' A' ' 18' ' ' LEU . 0.2 OUTLIER -50.9 -42.95 59.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.066 179.962 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.5 pp -89.28 0.72 56.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.691 -179.531 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -98.05 32.07 2.52 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.741 0.305 . . . . 0.0 110.85 -179.965 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.79 22.97 40.54 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.503 -179.843 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.533 ' CD1' HD11 ' A' ' 18' ' ' LEU . 34.2 t80 -106.99 141.71 37.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.803 0.335 . . . . 0.0 110.769 179.834 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.413 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 16.0 t70 -78.89 105.58 10.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.829 179.954 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.3 p30 -64.92 -14.26 59.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.455 -179.954 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.1 t -75.84 -20.99 57.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.606 0.241 . . . . 0.0 111.47 -179.866 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 14.3 p -88.8 -27.14 5.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.71 0.291 . . . . 0.0 111.614 -179.633 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 pp -59.11 -37.92 78.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.84 0.352 . . . . 0.0 110.956 -179.855 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -56.89 -24.96 55.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.192 -179.842 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -78.73 -44.73 22.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.152 -179.964 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.5 p -80.58 -48.96 19.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.313 -179.857 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.5 mp -54.0 -34.56 26.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 121.08 0.467 . . . . 0.0 110.228 179.45 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.491 ' HG ' ' HG2' ' A' ' 36' ' ' LYS . 0.9 OUTLIER -52.08 -61.34 2.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.317 179.471 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 39.1 m -54.23 -26.81 30.64 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.564 -179.867 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 32.8 mt -70.44 -49.51 47.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.758 0.313 . . . . 0.0 111.149 -179.766 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.1 mtm180 -77.35 -55.89 5.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.99 0.424 . . . . 0.0 110.806 -179.802 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.553 ' O ' ' CG ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -64.12 -16.7 62.38 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.599 -179.967 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.553 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 0.2 OUTLIER 53.35 73.06 0.39 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.332 179.807 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.492 ' HB2' ' HD2' ' A' ' 36' ' ' LYS . 20.4 tt0 -84.11 139.09 39.42 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.138 178.781 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -58.56 105.0 0.2 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.451 2.101 . . . . 0.0 112.034 179.894 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 50.1 mt -62.48 178.78 0.38 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.013 -179.777 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -140.14 163.52 43.52 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.779 -179.985 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -64.24 -27.91 64.19 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.602 2.202 . . . . 0.0 112.291 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.25 -17.92 64.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.247 179.942 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.416 ' CE2' ' HA ' ' A' ' 61' ' ' ILE . 3.6 m-85 -69.49 -10.7 59.17 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.48 -179.988 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 61.89 36.89 15.63 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.893 0.378 . . . . 0.0 110.902 -179.959 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.2 p-10 -75.77 84.42 2.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.879 179.789 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 -140.48 -177.61 5.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.061 -179.921 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.9 157.23 33.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.162 -179.945 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 53.9 mt -105.3 -178.35 3.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.913 180.0 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -118.08 175.17 5.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.91 -179.879 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 71.81 -138.19 26.73 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.546 -179.954 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.18 -28.19 69.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.694 0.283 . . . . 0.0 111.0 179.98 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 8.1 m95 -97.32 39.26 1.2 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.726 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.439 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 3.1 tmtp? -69.51 -51.38 16.65 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.314 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.439 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 81.9 Cg_endo -78.67 6.6 4.75 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.449 2.1 . . . . 0.0 112.878 -179.787 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -105.39 173.38 6.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.842 0.354 . . . . 0.0 110.87 179.93 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 23.1 ttm180 -131.74 142.9 49.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.979 -179.967 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -110.75 171.67 7.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.985 -179.914 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 8.3 t -160.78 118.47 2.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.719 179.882 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.409 ' CD2' ' N ' ' A' ' 60' ' ' HIS . 3.8 m-70 -94.4 78.7 3.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.977 -179.858 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.458 ' CD1' ' HB3' ' A' ' 67' ' ' LEU . 3.7 mp -57.06 -27.12 26.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.072 179.76 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.5 mtmm -139.37 169.26 12.71 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.708 179.991 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -69.19 -3.32 11.4 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.78 2.32 . . . . 0.0 112.875 -179.834 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -141.29 26.02 2.02 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.922 179.881 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 56.9 t -136.64 147.11 27.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.173 179.97 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.4 mt -144.31 97.98 3.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.647 179.846 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.458 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 4.2 tp -94.15 127.81 40.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.979 -179.865 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 46.6 t -105.08 136.35 39.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.727 179.769 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -147.89 153.67 39.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.054 179.964 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 3.6 tp -99.18 173.13 6.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.893 -179.995 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -123.68 102.94 12.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.181 -179.966 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 13.5 tptp -73.48 162.32 29.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.758 179.962 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -44.95 -43.33 8.92 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.376 -179.86 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -145.4 29.72 1.14 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.819 179.902 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.3 mp0 -157.39 167.99 28.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.802 -179.885 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.8 tp -120.19 139.13 53.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.797 179.902 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.3 pp -128.83 131.6 68.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.339 -179.806 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 71.9 mt -73.68 137.14 43.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.704 179.742 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.09 -72.01 0.63 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.021 -179.767 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -161.16 170.48 20.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.849 0.357 . . . . 0.0 111.32 -179.949 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -122.77 125.33 45.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.93 -179.943 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -135.43 -162.11 9.56 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.464 179.93 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -148.08 155.26 41.27 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.125 0.488 . . . . 0.0 110.909 -179.994 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -49.07 -28.14 3.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.359 -179.886 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 12.1 t -90.09 -22.13 21.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.152 179.823 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -82.71 -73.56 0.39 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.263 -179.83 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.1 mp -51.36 -33.8 31.22 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.289 -179.724 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.27 -0.871 . . . . 0.0 110.873 -179.994 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 120.809 0.338 . . . . 0.0 111.158 . . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.4 pp -164.95 175.73 9.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.873 179.949 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.31 150.89 24.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.913 -179.974 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.3 tp -125.16 138.33 54.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.8 179.923 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -118.58 169.58 9.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.835 -179.954 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 33.3 mt -132.21 112.68 12.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.881 -179.961 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.31 161.68 18.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.908 -179.989 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.7 tptt -61.38 -34.46 75.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.825 -179.985 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 39.3 m -69.69 -32.6 71.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.777 179.958 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -73.52 -38.48 65.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.856 -179.965 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -63.34 -37.58 87.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.802 -179.993 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.557 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 1.8 mttp -83.9 -25.56 30.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.234 0.54 . . . . 0.0 111.055 -179.999 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.445 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 1.2 m-20 -90.9 -9.42 46.31 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.067 179.805 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.461 ' O ' ' CD2' ' A' ' 18' ' ' LEU . 47.5 t80 -91.26 -68.02 0.82 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.14 -179.604 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -91.05 -34.59 15.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.806 -179.331 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.557 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -78.68 -15.21 58.75 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.167 -179.48 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.445 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 31.6 tp -80.55 -35.18 34.74 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.957 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.461 ' CD2' ' O ' ' A' ' 14' ' ' PHE . 1.0 OUTLIER -64.01 -53.37 51.1 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.914 179.71 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.3 mt -60.08 -36.96 78.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.928 179.984 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -24.9 61.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.948 179.901 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.97 37.88 0.24 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.639 179.915 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -121.63 163.59 18.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.802 0.334 . . . . 0.0 110.866 -179.987 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -76.13 125.45 29.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.101 -179.854 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.436 ' CB ' HD13 ' A' ' 18' ' ' LEU . 7.6 p-10 -93.26 -15.82 25.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.191 179.741 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.1 m -78.83 -34.69 45.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.787 0.327 . . . . 0.0 111.047 -179.678 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 11.7 p -66.81 -27.38 39.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.389 -179.87 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.433 HD11 ' CZ ' ' A' ' 14' ' ' PHE . 1.3 pp -64.78 -37.97 89.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.106 -179.803 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -61.52 -26.57 68.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.061 -179.988 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.412 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 2.2 mm-40 -74.81 -33.99 62.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.132 -179.869 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.7 p -90.65 -41.08 13.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.923 -179.645 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.5 mp -64.12 -54.91 25.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.718 -179.301 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.579 ' O ' ' HG2' ' A' ' 36' ' ' LYS . 0.8 OUTLIER -50.38 -22.53 1.89 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 -179.073 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 38.9 m -90.29 -42.57 10.9 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 120.659 0.266 . . . . 0.0 111.545 -179.725 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 21.9 mt -80.46 -31.72 37.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.952 -179.023 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.9 mtp-105 -91.38 20.39 5.28 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -179.238 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.579 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 0.6 OUTLIER -115.51 -45.67 2.9 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.11 -0.236 . . . . 0.0 111.635 -179.969 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.511 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 1.0 OUTLIER 150.99 -20.59 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 122.883 0.473 . . . . 0.0 111.082 179.55 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.15 112.11 10.67 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.129 -179.64 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.49 152.88 34.44 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.452 2.101 . . . . 0.0 112.177 179.807 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mt -76.68 115.76 16.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.826 -179.993 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.62 164.47 3.99 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.033 -179.864 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.62 -13.17 32.28 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.574 2.183 . . . . 0.0 112.604 179.943 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -83.57 3.61 31.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.407 -179.947 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -95.48 20.16 9.91 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.693 0.282 . . . . 0.0 111.181 179.999 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 58.0 mm-40 58.83 34.24 23.57 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.896 179.927 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.0 p-10 -82.9 114.88 21.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.892 -179.975 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -168.72 178.03 4.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.959 179.991 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.42 148.02 43.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.117 179.981 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 90.7 mt -102.4 -177.11 3.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.834 179.955 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.77 176.33 5.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.867 -179.915 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 67.93 -136.35 30.94 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.577 179.965 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.44 -25.84 68.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.718 0.295 . . . . 0.0 111.094 -179.869 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.41 ' CD1' HG23 ' A' ' 68' ' ' VAL . 18.5 m-90 -96.65 38.77 1.19 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.912 0.387 . . . . 0.0 110.984 -179.956 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.419 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.1 OUTLIER -73.13 -52.21 5.59 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.011 179.947 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 88.4 Cg_endo -83.2 13.89 2.52 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.646 2.231 . . . . 0.0 112.803 179.973 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.409 ' CD2' ' HG ' ' A' ' 79' ' ' LEU . 96.1 m-85 -114.14 179.18 4.03 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.863 0.363 . . . . 0.0 110.999 -179.921 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.14 149.8 52.43 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.886 -179.985 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -129.91 169.87 14.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.923 -179.963 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 37.5 t -165.04 129.21 2.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.931 -179.951 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.406 ' CD2' ' HB3' ' A' ' 66' ' ' LEU . 23.5 m170 -91.84 83.24 5.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.848 179.837 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.5 mp -56.91 -50.93 73.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.122 -179.966 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.426 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 0.0 OUTLIER -114.82 172.41 3.64 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.483 179.965 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.426 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 16.7 Cg_exo -67.17 -4.28 11.34 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.554 2.169 . . . . 0.0 112.851 -179.874 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -146.81 29.09 1.02 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.874 179.933 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 52.8 t -136.47 145.01 31.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.988 0.423 . . . . 0.0 111.383 179.934 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.406 ' HB3' ' CD2' ' A' ' 60' ' ' HIS . 0.0 OUTLIER -159.13 111.22 2.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.595 179.745 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -111.68 139.03 47.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.875 0.369 . . . . 0.0 111.103 -179.745 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.41 HG23 ' CD1' ' A' ' 53' ' ' TRP . 40.9 t -88.94 139.36 17.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.801 179.84 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.403 ' CD1' ' N ' ' A' ' 69' ' ' TYR . 2.3 p90 -153.84 175.58 13.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.037 -179.952 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.5 tp -130.16 150.13 51.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.888 179.979 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.6 t -106.97 111.43 35.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.109 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.68 168.72 9.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.89 179.963 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.21 108.78 1.14 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.93 -179.922 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.1 t0 57.98 24.2 10.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.069 179.885 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -160.02 141.21 12.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.817 179.989 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -119.93 148.16 43.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.896 -179.972 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.1 pp -131.49 134.32 60.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.26 -179.913 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 62.7 mt -84.93 135.39 34.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.671 179.781 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.409 ' HG ' ' CD2' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -93.73 -61.43 1.55 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.045 -179.927 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.4 175.05 4.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.973 0.416 . . . . 0.0 111.297 179.955 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -116.13 142.36 46.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.793 -179.971 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -148.5 -178.02 23.26 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.507 179.966 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 58.7 m -138.45 177.05 8.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.836 0.351 . . . . 0.0 110.907 179.944 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 8.4 t-80 -64.24 -29.99 71.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.943 -179.969 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.9 m -88.49 -29.95 19.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.895 -179.96 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.27 -68.13 0.55 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.886 -179.949 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 25.3 mt -69.7 -32.68 71.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.931 -179.979 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.938 179.983 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.1 mtm . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.717 0.294 . . . . 0.0 111.531 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 8.0 mt -76.97 176.57 8.51 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.889 0.376 . . . . 0.0 110.927 179.923 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.67 152.69 40.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.957 -179.966 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 tp -120.75 145.27 47.69 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.874 179.931 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -129.88 171.89 12.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.752 179.957 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.6 mp -140.79 119.97 12.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.829 179.997 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -93.58 -176.56 4.12 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.917 179.973 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.7 mmtt -74.18 -31.36 62.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.863 -179.972 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.57 -39.76 73.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.99 -179.96 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.413 ' CE2' HD13 ' A' ' 78' ' ' LEU . 60.3 t80 -71.95 -33.24 68.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.885 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -59.42 -47.09 86.78 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.989 179.964 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.516 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 0.9 OUTLIER -80.34 -13.45 59.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.12 179.892 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -90.72 -11.88 38.31 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.037 179.715 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.535 ' O ' HD11 ' A' ' 18' ' ' LEU . 76.6 t80 -90.69 -65.47 1.01 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.214 -179.612 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.433 ' HA ' HD21 ' A' ' 18' ' ' LEU . 1.8 t70 -91.36 -36.34 13.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.95 -179.324 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.516 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 2.0 mptt -72.37 -36.54 68.75 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.125 -179.046 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.8 tt -61.06 -32.07 71.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.996 0.427 . . . . 0.0 109.908 179.15 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.555 HD12 ' CD1' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -62.51 -23.49 66.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.146 179.89 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -90.06 15.05 10.84 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.446 -179.995 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -127.6 47.91 2.32 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.823 0.344 . . . . 0.0 110.844 -179.979 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.27 30.05 65.5 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.482 -179.923 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.555 ' CD1' HD12 ' A' ' 18' ' ' LEU . 8.6 t80 -120.73 124.55 45.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.784 0.326 . . . . 0.0 110.765 -179.921 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.435 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 25.5 t0 -79.53 140.47 37.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.204 -179.744 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -93.68 16.35 14.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.388 -179.977 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.5 t -90.06 -33.51 16.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.76 0.314 . . . . 0.0 111.348 -179.741 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.3 t -84.14 -38.14 13.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.573 -179.623 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.411 HD11 ' CE1' ' A' ' 14' ' ' PHE . 0.4 OUTLIER -59.86 -36.6 77.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.16 -179.667 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -52.23 -46.07 65.57 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.076 -179.927 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.407 ' HA ' HD13 ' A' ' 32' ' ' LEU . 5.3 mt-10 -64.94 -16.65 63.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.115 179.794 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 95.2 t -90.36 -74.37 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.034 0.445 . . . . 0.0 111.658 -179.541 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.7 mp -45.72 -44.03 4.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.874 -0.603 . . . . 0.0 112.263 -179.005 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.43 HD11 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -58.56 -19.65 39.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.72 0.295 . . . . 0.0 111.512 -179.431 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.43 ' N ' HD11 ' A' ' 32' ' ' LEU . 99.1 m -84.84 -28.74 25.85 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.83 0.348 . . . . 0.0 111.092 179.996 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 73.2 mt -89.9 -34.16 16.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.597 -179.349 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.5 mtp-105 -93.31 20.31 7.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.852 -179.346 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.45 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 10.3 mttm -110.04 -55.5 2.44 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 121.159 -0.216 . . . . 0.0 110.98 179.719 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.45 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 159.72 -20.53 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.27 179.613 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -83.38 118.33 71.25 Favored Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 116.713 -0.222 . . . . 0.0 111.083 -179.71 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -75.99 -179.39 5.16 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.462 2.108 . . . . 0.0 112.295 179.776 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.7 mt -98.89 157.35 16.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.779 179.968 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -96.56 157.75 34.84 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.024 -179.921 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.29 -3.28 13.68 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.632 2.221 . . . . 0.0 112.817 -179.982 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -92.6 17.71 9.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.694 0.283 . . . . 0.0 111.206 179.858 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -113.46 21.52 15.07 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.744 0.307 . . . . 0.0 110.985 179.901 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 62.79 43.92 6.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.828 179.986 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.7 p-10 -88.75 66.21 7.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.853 179.946 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -120.28 178.3 4.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.882 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.77 163.06 28.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.087 -179.991 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.4 mt -106.7 176.76 5.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.886 179.961 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.3 mmtt -116.67 157.07 26.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.041 179.989 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 82.68 -140.22 20.09 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.543 179.978 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm -58.47 -22.92 56.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.737 0.304 . . . . 0.0 111.219 179.999 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 5.0 m95 -96.17 38.48 1.19 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.928 179.953 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.415 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -75.4 -52.19 3.06 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.116 -179.922 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.415 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 90.1 Cg_endo -79.75 47.06 2.4 Favored 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 122.43 2.087 . . . . 0.0 112.347 -179.933 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.456 ' CD1' ' CD2' ' A' ' 79' ' ' LEU . 77.9 m-85 -154.57 178.37 10.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.856 179.878 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -137.17 134.76 36.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.004 -179.981 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -98.8 171.85 7.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.79 179.891 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 14.8 t -168.36 116.66 0.71 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.901 179.985 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.421 ' CD2' HD21 ' A' ' 66' ' ' LEU . 11.3 m170 -93.31 79.04 4.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.915 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.412 ' CD1' ' HB3' ' A' ' 67' ' ' LEU . 2.5 mp -55.19 -26.87 19.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.193 179.843 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.431 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 2.7 mtpp -137.72 166.93 22.65 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.767 -179.751 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.431 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 48.2 Cg_endo -68.58 -2.57 9.51 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.351 2.034 . . . . 0.0 112.789 179.929 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -143.47 27.4 1.54 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.662 179.62 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 60.9 t -136.9 146.38 28.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.208 -179.956 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.421 HD21 ' CD2' ' A' ' 60' ' ' HIS . 5.8 mt -144.24 102.85 3.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.525 179.421 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.412 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 5.2 tp -102.63 131.42 49.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.141 -179.651 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 46.9 t -104.71 138.17 30.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.841 179.843 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 52.5 p90 -157.35 161.59 39.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.063 179.993 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.2 tp -109.36 -176.31 2.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.856 180.0 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.4 t -127.27 104.82 12.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.137 -179.99 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.62 172.61 8.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.871 179.923 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -57.99 102.55 0.11 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.906 179.893 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 58.17 24.75 11.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.961 -179.899 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -151.53 162.49 40.88 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.803 180.0 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.1 tp -123.41 147.66 46.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.832 -179.935 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.4 pp -131.95 128.92 60.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.154 -179.885 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.413 HD13 ' CE2' ' A' ' 10' ' ' PHE . 70.1 mt -73.83 155.4 38.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.684 179.744 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.456 ' CD2' ' CD1' ' A' ' 56' ' ' PHE . 0.3 OUTLIER -117.21 -68.16 0.94 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.94 -179.909 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.81 166.75 29.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.09 179.966 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -121.27 137.85 54.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.824 -179.952 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -154.83 -164.67 13.18 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.638 -179.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.9 p -142.57 176.67 8.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.892 0.377 . . . . 0.0 110.875 179.997 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 26.7 t-80 -59.27 -27.5 65.87 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.049 -179.904 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.6 m -78.85 -28.89 44.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.087 -179.878 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -84.24 -72.98 0.44 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.023 -179.963 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.6 mp -60.72 -39.93 90.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.021 -179.964 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.9 -179.961 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.559 HD13 ' HB2' ' A' ' 76' ' ' LEU . 3.2 pp . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.839 0.352 . . . . 0.0 111.073 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.412 ' HD2' ' N ' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -82.36 153.99 25.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.916 -179.875 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.412 ' N ' ' HD2' ' A' ' 3' ' ' LYS . 3.1 tp -121.98 146.3 47.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.842 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.599 ' HB2' HG22 ' A' ' 77' ' ' ILE . 3.6 t30 -136.03 173.68 11.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.861 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.3 mp -144.56 138.02 27.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.981 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.3 mmtp -106.03 171.04 7.56 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.844 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 41.0 tttt -59.23 -30.08 67.99 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.99 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.1 t -70.42 -55.89 7.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.958 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.428 ' HE1' HD13 ' A' ' 67' ' ' LEU . 49.8 t80 -59.08 -33.8 71.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.973 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -60.56 -42.05 95.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.938 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.573 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 3.7 mtpt -89.97 -16.42 29.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.023 0.44 . . . . 0.0 111.464 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -90.75 -11.48 39.41 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.293 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.778 ' O ' HD13 ' A' ' 18' ' ' LEU . 13.9 t80 -90.34 -69.88 0.7 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.806 0.336 . . . . 0.0 111.349 -179.456 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.776 ' HA ' HD22 ' A' ' 18' ' ' LEU . 5.4 t0 -90.76 -29.6 17.53 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -178.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.573 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.6 OUTLIER -79.0 -17.76 54.81 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.374 -179.284 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.409 ' O ' ' HB3' ' A' ' 22' ' ' PHE . 38.2 tp -87.18 -34.5 19.0 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 179.295 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.778 HD13 ' O ' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -51.78 -49.43 62.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.851 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 pp -84.28 2.48 39.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.708 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.75 32.02 2.74 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.938 0.399 . . . . 0.0 110.781 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.86 22.99 43.59 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.524 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.534 ' CD1' HD12 ' A' ' 18' ' ' LEU . 35.9 t80 -103.77 139.28 39.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.832 0.349 . . . . 0.0 110.709 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.835 ' O ' HG12 ' A' ' 26' ' ' VAL . 45.6 t0 -70.48 97.79 1.35 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.823 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.682 ' HA ' HD23 ' A' ' 27' ' ' LEU . 2.1 p30 -68.56 -12.71 61.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.486 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.2 p -73.96 -24.78 59.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.684 -0.234 . . . . 0.0 111.358 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.835 HG12 ' O ' ' A' ' 23' ' ' ASP . 11.4 p -86.06 -26.2 6.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.465 -179.769 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.682 HD23 ' HA ' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -64.33 -37.24 86.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.833 0.349 . . . . 0.0 110.899 -179.897 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -55.04 -22.19 14.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.315 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -85.94 -46.8 10.22 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.78 0.324 . . . . 0.0 111.362 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.691 HG13 HD12 ' A' ' 31' ' ' ILE . 9.5 p -75.04 -46.35 40.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.182 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.691 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -66.19 -15.87 19.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.795 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.501 HD23 ' N ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -80.4 -27.87 38.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.257 -179.823 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.501 ' N ' HD23 ' A' ' 32' ' ' LEU . 58.0 m -87.34 -28.02 22.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.74 -179.324 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.792 HD21 HD21 ' A' ' 40' ' ' LEU . 65.7 mt -90.2 -33.05 16.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.671 -179.313 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.8 mtp-105 -93.29 20.21 7.31 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.209 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.457 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -116.12 -55.94 2.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.583 0.23 . . . . 0.0 111.071 179.673 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.457 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.1 OUTLIER 158.27 -20.48 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.14 179.612 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.87 111.68 9.11 Favored Pre-proline 0 CA--C 1.53 0.182 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.067 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.69 156.8 53.07 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.428 2.085 . . . . 0.0 112.181 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.792 HD21 HD21 ' A' ' 34' ' ' LEU . 67.2 mt -65.66 141.8 58.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.96 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -90.15 155.92 46.67 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.04 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.02 -9.06 24.04 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.636 2.224 . . . . 0.0 112.576 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.66 3.68 31.89 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.473 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -94.41 17.99 12.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.611 0.243 . . . . 0.0 111.255 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 54.97 37.36 28.72 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.784 0.326 . . . . 0.0 110.998 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -77.35 121.44 23.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.057 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -172.95 -170.04 0.62 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.886 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.19 134.24 37.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.048 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.454 HD21 ' HB2' ' A' ' 58' ' ' GLU . 3.9 mp -76.68 177.79 7.26 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.936 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.5 mtmm -113.89 152.65 30.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.891 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.36 -134.92 12.23 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.554 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.99 -13.0 60.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.654 0.264 . . . . 0.0 111.382 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 13.2 m95 -96.56 39.06 1.17 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.796 0.331 . . . . 0.0 110.875 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.461 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 6.9 tttm -69.25 -51.02 18.42 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.47 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 74.6 Cg_endo -78.36 47.88 2.54 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.305 2.003 . . . . 0.0 112.654 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.664 ' CE1' HD21 ' A' ' 79' ' ' LEU . 70.2 m-85 -154.24 170.96 20.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.808 0.337 . . . . 0.0 110.879 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.2 ttm105 -130.46 134.79 47.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.052 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.454 ' HB2' HD21 ' A' ' 49' ' ' LEU . 1.5 tm-20 -108.04 162.6 13.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.952 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 15.0 t -171.09 114.22 0.41 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.771 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.452 ' CG ' ' O ' ' A' ' 60' ' ' HIS . 16.9 p80 -90.18 85.11 6.17 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.077 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.581 HG21 HG23 ' A' ' 30' ' ' VAL . 3.8 mp -53.86 -26.85 14.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.968 179.669 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.542 ' HB2' HG23 ' A' ' 65' ' ' VAL . 18.3 mmmt -135.57 161.72 61.38 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.443 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.54 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 37.8 Cg_endo -66.16 -2.3 6.72 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.265 1.976 . . . . 0.0 112.89 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -137.99 23.7 2.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.794 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.812 ' O ' HD23 ' A' ' 66' ' ' LEU . 48.3 t -135.71 149.15 27.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.141 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.812 HD23 ' O ' ' A' ' 65' ' ' VAL . 2.1 mt -147.22 85.17 1.59 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.621 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.719 HD12 ' N ' ' A' ' 68' ' ' VAL . 4.9 tp -86.59 127.87 34.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.124 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.719 ' N ' HD12 ' A' ' 67' ' ' LEU . 52.0 t -102.4 138.08 28.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.011 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -151.88 170.74 19.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.954 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.747 ' HB2' HD11 ' A' ' 77' ' ' ILE . 7.8 tp -122.82 151.04 42.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.954 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 28.2 t -102.86 109.6 27.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.125 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.88 173.7 6.19 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.77 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -59.95 103.96 0.26 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.941 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 54.16 24.65 5.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.15 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -150.48 139.58 21.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.875 0.369 . . . . 0.0 110.955 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.559 ' HB2' HD13 ' A' ' 2' ' ' LEU . 6.2 tp -111.16 150.04 30.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.818 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.747 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.2 pp -135.88 130.34 48.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.44 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 80.6 mt -81.24 127.85 33.15 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.624 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.664 HD21 ' CE1' ' A' ' 56' ' ' PHE . 0.0 OUTLIER -88.34 -73.3 0.5 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.055 -179.77 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.455 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -155.92 174.27 15.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.987 -179.883 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.751 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.4 tm? -127.35 139.36 52.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.856 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.751 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -151.55 -176.69 24.59 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.453 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 70.2 m -132.85 167.59 19.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.854 0.359 . . . . 0.0 110.753 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -56.76 -31.16 64.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.923 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.5 m -90.33 -22.7 21.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.325 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.58 -67.54 0.78 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.367 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.526 HD12 ' CD1' ' A' ' 66' ' ' LEU . 25.8 mt -51.33 -26.02 6.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.363 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.885 179.989 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.1 mp . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.912 0.387 . . . . 0.0 110.85 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.43 160.24 7.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.889 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.718 HD21 HD11 ' A' ' 78' ' ' LEU . 0.4 OUTLIER -125.21 155.86 39.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.043 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.811 ' HB2' HG22 ' A' ' 77' ' ' ILE . 0.8 OUTLIER -149.61 -178.08 6.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.944 -179.915 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 21.7 mt -140.23 141.02 35.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.847 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.633 ' HE2' HD13 ' A' ' 77' ' ' ILE . 14.4 mmtm -115.17 171.9 7.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.928 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.3 mtmm -70.19 -33.15 71.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.927 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.48 -34.38 78.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.827 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -66.51 -29.96 70.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.874 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -64.31 -48.61 74.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.6 mtpt -69.92 -24.46 63.38 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.042 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.523 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 7.1 m-20 -90.07 -22.98 21.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.02 0.438 . . . . 0.0 111.049 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.772 ' O ' HD23 ' A' ' 18' ' ' LEU . 73.4 t80 -90.9 -39.21 12.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.55 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -93.05 -58.06 2.44 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.105 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -47.21 68.58 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.672 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.57 HD23 ' CB ' ' A' ' 22' ' ' PHE . 3.0 tt -48.17 -39.48 21.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.235 0.54 . . . . 0.0 110.899 -179.136 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.772 HD23 ' O ' ' A' ' 14' ' ' PHE . 2.3 mm? -62.64 -32.43 73.48 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.904 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 19' ' ' LEU . 21.0 mt -90.07 12.73 16.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.301 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -113.86 29.55 7.92 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.874 0.369 . . . . 0.0 110.86 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.23 22.88 46.58 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.796 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.72 ' HD2' HD13 ' A' ' 18' ' ' LEU . 83.4 t80 -113.34 122.93 48.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.923 0.392 . . . . 0.0 110.817 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.417 ' O ' ' CD2' ' A' ' 22' ' ' PHE . 3.4 t0 -58.37 159.66 5.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.867 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.665 ' HA ' HD23 ' A' ' 27' ' ' LEU . 22.7 p-10 -108.69 -29.09 8.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.073 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.3 t -55.5 -23.57 26.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.169 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 20.6 t -79.46 -46.72 22.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.282 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.665 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -58.82 -28.57 66.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.94 -179.874 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -68.23 -15.77 63.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.228 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -90.14 -37.1 14.43 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.344 -179.679 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.771 HG13 ' CD1' ' A' ' 31' ' ' ILE . 7.5 p -82.49 -34.26 11.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.819 0.342 . . . . 0.0 111.155 -179.684 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.771 ' CD1' HG13 ' A' ' 30' ' ' VAL . 1.6 mp -76.47 -23.31 15.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.789 179.671 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.55 HD23 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -74.5 -24.77 59.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.076 -179.962 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.55 ' N ' HD23 ' A' ' 32' ' ' LEU . 89.4 m -90.1 -22.2 21.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.707 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.765 HD21 HD21 ' A' ' 40' ' ' LEU . 12.5 mt -90.45 -42.42 10.88 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 54.9 mtt180 -77.75 -40.27 41.56 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.647 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.467 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.2 OUTLIER -53.47 -55.78 22.39 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 121.197 -0.201 . . . . 0.0 111.485 -179.162 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.467 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 157.45 -20.41 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.087 179.736 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.37 123.03 27.45 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.159 -179.767 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.35 162.95 35.45 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.45 2.1 . . . . 0.0 112.264 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.765 HD21 HD21 ' A' ' 34' ' ' LEU . 83.6 mt -94.43 103.07 15.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.731 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -57.12 153.23 25.74 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.003 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -69.22 -10.35 28.75 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.504 2.136 . . . . 0.0 112.544 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.54 5.84 29.73 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.34 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -84.25 2.91 37.8 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.724 -0.216 . . . . 0.0 111.312 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 61.93 40.15 12.79 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.88 0.372 . . . . 0.0 111.033 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -78.71 87.21 4.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.767 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -120.53 176.06 5.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.038 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.1 175.26 0.54 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.11 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.73 HD11 HG22 ' A' ' 68' ' ' VAL . 0.2 OUTLIER -113.7 -175.74 2.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.775 179.973 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.5 mmtm -135.29 157.61 46.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.879 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.06 -116.61 4.71 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.578 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.62 -24.79 26.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.784 0.326 . . . . 0.0 110.997 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 10.7 m95 -97.43 33.18 2.06 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.879 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.475 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 12.1 tttm -57.73 -50.19 89.49 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.405 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 72.3 Cg_endo -77.3 4.39 5.92 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.323 2.015 . . . . 0.0 113.009 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -106.75 174.84 5.71 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.753 0.311 . . . . 0.0 110.926 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.438 ' O ' HG13 ' A' ' 68' ' ' VAL . 10.1 ttm180 -126.37 150.66 48.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.907 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.478 ' HG3' HD11 ' A' ' 49' ' ' LEU . 6.5 tt0 -111.51 172.16 7.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.893 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.527 ' SG ' HD13 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -156.86 116.71 3.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.788 179.947 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.714 ' CE1' HD22 ' A' ' 66' ' ' LEU . 10.3 m-70 -95.76 80.36 3.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.054 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.697 HD13 ' CG2' ' A' ' 30' ' ' VAL . 3.7 mp -67.23 -38.98 82.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.04 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.432 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 5.0 mttm -122.27 168.3 11.97 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.748 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.432 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 55.3 Cg_endo -69.67 -2.08 9.5 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.322 2.015 . . . . 0.0 112.824 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.9 p30 -144.35 26.88 1.44 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.773 179.676 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.854 ' O ' HD23 ' A' ' 66' ' ' LEU . 90.6 t -133.28 141.13 45.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.102 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.854 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.0 OUTLIER -157.19 94.06 1.37 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.632 179.749 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.571 HD12 ' O ' ' A' ' 68' ' ' VAL . 0.2 OUTLIER -101.72 136.55 41.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.918 -179.859 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.73 HG22 HD11 ' A' ' 49' ' ' LEU . 38.8 t -84.63 140.79 15.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.011 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.731 ' CD1' HD11 ' A' ' 76' ' ' LEU . 32.0 p90 -143.87 158.76 43.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.889 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.751 ' HB2' HD11 ' A' ' 77' ' ' ILE . 4.5 tp -105.37 164.24 12.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.886 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.2 t -114.55 115.93 51.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.058 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -111.39 170.72 7.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.811 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.5 p-10 -64.47 103.81 0.71 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.817 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.3 t70 60.46 19.53 9.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.198 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -151.34 143.09 23.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.843 0.354 . . . . 0.0 110.848 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.731 HD11 ' CD1' ' A' ' 69' ' ' TYR . 8.2 tt -119.35 139.8 51.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.914 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.811 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.4 pp -122.9 135.54 62.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.177 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.718 HD11 HD21 ' A' ' 4' ' ' LEU . 64.0 mt -76.29 143.03 41.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.75 179.804 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.4 -70.88 0.75 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.11 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.438 ' NH1' HD21 ' A' ' 87' ' ' LEU . 0.1 OUTLIER -154.57 173.04 16.86 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.95 0.405 . . . . 0.0 111.42 -179.859 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.624 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.4 tm? -112.67 133.62 54.61 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.91 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.624 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -136.25 171.78 22.69 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.427 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 18.1 m -135.16 170.15 16.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.777 0.322 . . . . 0.0 110.898 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -58.99 -29.37 67.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.993 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.4 t -90.01 -28.29 19.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.987 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.28 -71.74 0.37 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.022 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.635 HD12 HD12 ' A' ' 66' ' ' LEU . 13.6 mt -69.33 -34.87 75.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.03 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.242 -0.885 . . . . 0.0 110.901 -179.955 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.9 mt . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.777 0.322 . . . . 0.0 110.918 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.403 ' HD2' ' N ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -52.86 151.36 4.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.044 179.97 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.742 HD11 HD11 ' A' ' 78' ' ' LEU . 7.6 tt -115.73 136.31 53.19 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.9 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.74 ' HB2' HG22 ' A' ' 77' ' ' ILE . 10.2 t30 -119.39 175.34 5.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.853 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 17.8 mt -141.98 114.05 8.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.011 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.8 mmpp? -95.64 -177.91 4.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.876 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.94 -31.2 56.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.847 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.4 -31.24 63.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.922 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -79.42 -30.91 42.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.98 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -59.5 -45.58 91.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.993 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.46 ' HA ' ' CB ' ' A' ' 16' ' ' LYS . 4.0 mttt -82.02 -18.96 41.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.261 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.485 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 6.3 m-20 -90.5 -17.39 27.17 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.083 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.501 ' O ' HD21 ' A' ' 18' ' ' LEU . 88.7 t80 -91.35 -65.48 1.01 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.22 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.453 ' O ' HD12 ' A' ' 19' ' ' LEU . 10.6 t70 -90.86 -45.62 8.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.138 -179.118 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.46 ' CB ' ' HA ' ' A' ' 12' ' ' LYS . 2.9 ttmt -70.55 -14.56 62.55 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.393 -179.195 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.485 ' HB2' ' HA ' ' A' ' 13' ' ' ASP . 26.6 tp -79.65 -39.12 32.16 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.787 HD13 ' CB ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -68.27 -43.11 78.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.711 179.734 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.453 HD12 ' O ' ' A' ' 15' ' ' ASP . 0.4 OUTLIER -65.51 -34.21 77.73 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.695 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -65.23 -24.62 67.39 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.002 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 133.13 41.93 0.17 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.546 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -124.34 140.67 52.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.802 0.334 . . . . 0.0 110.885 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.527 ' OD2' HG23 ' A' ' 26' ' ' VAL . 2.2 t70 -63.68 114.34 3.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.944 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.787 ' CB ' HD13 ' A' ' 18' ' ' LEU . 7.3 p-10 -72.08 -32.28 66.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.4 t -60.65 -49.84 75.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.383 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.527 HG23 ' OD2' ' A' ' 23' ' ' ASP . 60.1 t -51.46 -35.29 16.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.439 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.598 HD12 HD13 ' A' ' 31' ' ' ILE . 0.4 OUTLIER -66.42 -31.81 72.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.899 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -55.24 -47.24 75.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.931 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.4 ' HA ' HD22 ' A' ' 32' ' ' LEU . 2.6 mt-10 -57.39 -20.97 33.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.135 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.756 HG21 HG11 ' A' ' 65' ' ' VAL . 53.7 t -87.66 -69.4 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.011 0.434 . . . . 0.0 111.203 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.598 HD13 HD12 ' A' ' 27' ' ' LEU . 1.8 mp -48.9 -54.15 5.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.083 -179.327 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.741 HD23 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -55.27 -23.32 22.28 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.608 0.242 . . . . 0.0 111.281 -179.393 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.741 ' N ' HD23 ' A' ' 32' ' ' LEU . 82.0 m -89.93 -26.22 20.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.757 0.313 . . . . 0.0 111.157 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.718 HD21 HD21 ' A' ' 40' ' ' LEU . 73.0 mt -90.1 -30.49 17.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.402 -179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.419 ' CD ' HG23 ' A' ' 31' ' ' ILE . 38.1 mtm180 -95.17 20.16 9.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.722 -179.503 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.469 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -113.79 -55.58 2.49 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 121.1 -0.24 . . . . 0.0 111.071 179.966 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.469 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 157.43 -20.6 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.114 179.605 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.96 110.9 3.96 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.01 -179.723 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.22 147.76 33.55 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.53 2.154 . . . . 0.0 112.248 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.775 HD13 ' SG ' ' A' ' 59' ' ' CYS . 3.7 mt -80.89 111.9 17.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.763 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -57.67 155.32 21.86 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.137 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -67.19 -11.58 32.74 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.616 2.211 . . . . 0.0 112.531 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.94 4.77 28.2 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.405 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -94.72 19.06 10.53 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.189 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 11.3 mp0 60.29 41.33 16.6 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.88 0.371 . . . . 0.0 110.984 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.1 p-10 -88.5 96.52 10.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.851 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 56.4 m80 -143.78 177.52 8.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.895 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.88 167.3 6.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.195 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.671 HD11 ' HG3' ' A' ' 58' ' ' GLU . 6.3 mt -114.49 -179.0 3.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.917 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.3 mtpp -131.27 153.98 48.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.843 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 100.16 -109.07 3.62 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.608 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.3 mmtt -101.58 -23.35 14.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.746 0.307 . . . . 0.0 111.111 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 4.9 m95 -96.07 29.13 2.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.032 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.552 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 1.0 OUTLIER -59.04 -54.65 54.38 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.31 -179.93 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 27.1 Cg_endo -62.73 -10.49 19.92 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.267 1.978 . . . . 0.0 112.507 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.617 ' HD1' HD13 ' A' ' 70' ' ' LEU . 13.6 m-85 -99.52 168.26 10.08 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.802 0.334 . . . . 0.0 110.834 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.608 ' O ' HG13 ' A' ' 68' ' ' VAL . 5.0 ttp180 -120.51 150.05 41.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.922 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.671 ' HG3' HD11 ' A' ' 49' ' ' LEU . 2.0 tt0 -104.14 172.96 6.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.009 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.775 ' SG ' HD13 ' A' ' 40' ' ' LEU . 7.0 t -171.1 105.1 0.23 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.76 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.754 ' ND1' HD22 ' A' ' 66' ' ' LEU . 6.7 m170 -78.53 91.83 4.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.041 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.56 ' H ' HD12 ' A' ' 61' ' ' ILE . 4.1 mp -61.78 -41.33 90.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.957 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.448 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 0.2 OUTLIER -130.45 173.84 5.34 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.488 179.968 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.448 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 18.2 Cg_exo -66.15 -4.95 11.28 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.663 2.242 . . . . 0.0 112.796 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -145.13 29.71 1.17 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.866 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.878 ' O ' HD23 ' A' ' 66' ' ' LEU . 77.3 t -143.41 138.21 26.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.237 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.885 HD12 HD13 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -154.22 110.46 3.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.413 179.664 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.581 HD12 ' N ' ' A' ' 68' ' ' VAL . 0.1 OUTLIER -112.62 133.42 54.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.035 -179.781 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.612 HG22 HD11 ' A' ' 49' ' ' LEU . 37.8 t -91.17 142.68 12.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.785 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.592 ' CD2' HD11 ' A' ' 76' ' ' LEU . 54.2 p90 -154.33 163.3 40.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.855 0.359 . . . . 0.0 111.111 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.617 HD13 ' HD1' ' A' ' 56' ' ' PHE . 7.0 tp -110.4 169.63 8.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.776 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 18.4 t -123.19 109.38 23.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.264 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.16 161.53 18.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.8 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -43.91 -61.61 1.39 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.445 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -123.85 28.3 6.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.905 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.7 mp0 -160.16 174.33 14.42 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.843 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.592 HD11 ' CD2' ' A' ' 69' ' ' TYR . 4.4 tt -136.42 149.06 48.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.736 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.74 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.3 pp -132.4 130.09 59.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.329 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.742 HD11 HD11 ' A' ' 4' ' ' LEU . 52.0 mt -76.46 137.39 39.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.612 179.652 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.17 -69.05 0.77 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.217 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.66 153.83 23.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.372 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.606 ' C ' HD13 ' A' ' 81' ' ' LEU . 3.2 tm? -113.13 126.96 56.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.667 179.85 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.72 ' HA3' HD11 ' A' ' 87' ' ' LEU . . . -144.71 -171.48 14.57 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.557 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.465 ' O ' HD12 ' A' ' 87' ' ' LEU . 15.3 t -127.73 171.44 11.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.77 0.319 . . . . 0.0 110.841 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.583 ' HA ' HD11 ' A' ' 66' ' ' LEU . 2.3 t60 -60.33 -29.88 69.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.961 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 37.6 m -81.37 -24.99 36.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.008 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.19 -72.04 0.46 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.998 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.885 HD13 HD12 ' A' ' 66' ' ' LEU . 3.6 mp -63.24 -38.96 93.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.912 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.196 -0.907 . . . . 0.0 110.892 -179.956 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.3 mt . . . . . 0 C--O 1.231 0.132 0 CA-C-O 120.799 0.333 . . . . 0.0 110.997 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.0 tmmm? -71.74 152.11 43.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.867 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.525 HD11 HD11 ' A' ' 78' ' ' LEU . 2.3 tt -122.01 143.52 49.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.931 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.54 ' HB2' HG22 ' A' ' 77' ' ' ILE . 8.1 t30 -128.62 -175.76 3.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.898 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.401 HD11 HH22 ' A' ' 35' ' ' ARG . 2.7 mp -144.43 128.51 17.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.973 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.87 -175.24 2.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.909 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.22 -38.1 43.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.908 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.2 m -68.17 -41.08 82.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.915 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.419 ' CZ ' HD13 ' A' ' 78' ' ' LEU . 20.7 t80 -58.86 -30.46 67.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.938 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -62.86 -46.47 87.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.954 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.565 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 1.2 mmmm -81.92 -20.47 38.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.004 0.43 . . . . 0.0 111.185 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.404 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 20.1 m-20 -90.45 -10.94 41.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.082 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.702 ' O ' HD13 ' A' ' 18' ' ' LEU . 27.7 t80 -90.59 -69.0 0.75 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.875 0.369 . . . . 0.0 111.117 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.775 ' HA ' HD22 ' A' ' 18' ' ' LEU . 2.0 t70 -91.15 -32.71 15.72 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.565 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -76.08 -25.81 55.88 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 120.706 -0.398 . . . . 0.0 111.444 -178.99 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.439 ' O ' ' HB3' ' A' ' 22' ' ' PHE . 0.6 OUTLIER -75.64 -33.23 60.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.017 0.437 . . . . 0.0 110.037 179.182 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.775 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.2 OUTLIER -55.63 -42.55 75.13 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.85 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.542 ' C ' HD12 ' A' ' 19' ' ' LEU . 4.5 pp -83.99 -0.86 53.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.479 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.01 36.24 1.59 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.883 0.373 . . . . 0.0 110.94 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.18 25.8 46.83 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.397 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.441 ' CD1' HD12 ' A' ' 18' ' ' LEU . 11.5 t80 -114.08 130.47 56.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.722 0.296 . . . . 0.0 110.806 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.62 ' HB3' HG23 ' A' ' 26' ' ' VAL . 4.8 t70 -72.71 116.11 12.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.951 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.809 ' HA ' HD23 ' A' ' 27' ' ' LEU . 20.1 p-10 -68.33 -25.07 64.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.14 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.7 m -64.71 -21.15 66.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.296 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.62 HG23 ' HB3' ' A' ' 23' ' ' ASP . 21.8 t -83.93 -40.42 15.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.474 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.809 HD23 ' HA ' ' A' ' 24' ' ' ASP . 1.2 pp -57.78 -36.1 71.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.804 0.335 . . . . 0.0 111.129 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.694 ' O ' HD12 ' A' ' 32' ' ' LEU . 15.1 t-20 -57.36 -20.6 30.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.418 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -84.55 -37.49 21.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.693 0.282 . . . . 0.0 111.34 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.906 HG23 HG21 ' A' ' 61' ' ' ILE . 8.0 p -90.41 -36.62 8.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.849 -179.51 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.712 HD12 HG13 ' A' ' 30' ' ' VAL . 1.4 mp -71.13 -50.03 44.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.588 -179.262 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.93 HD13 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -57.91 -18.92 26.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.549 0.214 . . . . 0.0 111.462 -179.454 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.93 ' N ' HD13 ' A' ' 32' ' ' LEU . 85.1 m -84.75 -30.85 24.35 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.9 0.381 . . . . 0.0 110.703 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.795 HD21 HD21 ' A' ' 40' ' ' LEU . 66.0 mt -89.55 -30.73 18.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.444 -179.576 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.401 HH22 HD11 ' A' ' 6' ' ' LEU . 13.4 mtt-85 -93.55 20.18 7.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.774 -179.485 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.443 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 24.4 mttm -119.47 -55.45 2.12 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.576 0.227 . . . . 0.0 111.024 179.791 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.443 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 159.62 -20.65 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.199 179.751 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -65.89 111.24 5.92 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.028 -179.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.95 -179.97 3.87 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.48 2.12 . . . . 0.0 112.2 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.795 HD21 HD21 ' A' ' 34' ' ' LEU . 44.1 mt -102.44 117.45 34.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.9 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -61.45 157.04 48.77 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.042 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -69.03 -10.28 28.71 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.582 2.188 . . . . 0.0 112.548 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.87 11.19 18.66 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.31 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.443 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.4 m-85 -88.48 5.25 43.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.26 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 63.48 36.73 11.06 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.852 0.358 . . . . 0.0 110.897 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -80.65 110.37 16.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.902 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -148.56 174.76 11.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.846 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -92.44 128.26 38.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.088 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.776 HD11 ' CD ' ' A' ' 58' ' ' GLU . 24.7 mt -78.66 -167.9 1.23 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.847 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.2 mmtm -130.26 164.53 24.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.85 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 79.44 -122.78 5.89 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.456 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.32 -30.23 64.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.842 0.353 . . . . 0.0 110.831 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.469 ' HB3' HD12 ' A' ' 49' ' ' LEU . 33.1 m95 -98.45 27.35 4.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.928 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.517 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -75.94 -50.45 3.14 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.775 -179.678 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.517 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 53.0 Cg_endo -70.75 -3.26 12.31 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.165 1.91 . . . . 0.0 112.905 -179.564 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.431 ' CE2' ' HG2' ' A' ' 55' ' ' PRO . 39.3 m-85 -114.35 167.39 10.75 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.834 0.35 . . . . 0.0 110.749 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 11.1 ttm180 -117.03 141.54 48.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.046 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.776 ' CD ' HD11 ' A' ' 49' ' ' LEU . 1.0 OUTLIER -98.09 171.72 8.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.017 -179.835 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.79 ' SG ' HD13 ' A' ' 40' ' ' LEU . 5.8 t -169.94 122.09 0.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.776 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -101.72 87.31 3.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.082 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.906 HG21 HG23 ' A' ' 30' ' ' VAL . 3.5 mp -64.38 -51.2 71.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.871 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.562 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 16.7 mmmt -118.32 167.7 10.96 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.205 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.562 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 55.9 Cg_endo -70.86 1.75 4.84 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.081 1.854 . . . . 0.0 112.899 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -142.17 25.02 1.94 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.778 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.808 ' O ' HD23 ' A' ' 66' ' ' LEU . 44.1 t -140.17 149.75 21.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.177 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.808 HD23 ' O ' ' A' ' 65' ' ' VAL . 5.8 mt -146.41 101.84 3.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.878 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.633 ' HB3' HD11 ' A' ' 61' ' ' ILE . 3.4 tm? -95.09 131.97 40.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.953 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.67 HG22 ' OE1' ' A' ' 58' ' ' GLU . 81.8 t -107.24 110.95 33.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.362 179.107 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.722 ' CE1' HD11 ' A' ' 76' ' ' LEU . 26.9 p90 -124.81 162.65 23.85 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.101 -179.36 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.787 ' HB2' HD11 ' A' ' 77' ' ' ILE . 1.5 tp -118.46 133.36 55.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.867 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.511 HG22 ' N ' ' A' ' 72' ' ' LYS . 7.2 p -74.47 158.52 5.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.046 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.511 ' N ' HG22 ' A' ' 71' ' ' VAL . 1.3 tptt -159.35 171.57 19.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.834 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -59.53 100.09 0.07 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.986 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 52.83 23.94 3.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.238 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -148.88 147.05 28.23 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.833 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.722 HD11 ' CE1' ' A' ' 69' ' ' TYR . 0.5 OUTLIER -121.05 151.59 39.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.92 179.915 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.787 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.2 pp -133.42 130.91 57.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.269 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.525 HD11 HD11 ' A' ' 4' ' ' LEU . 67.7 mt -80.26 124.75 29.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.785 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.42 ' HG ' ' CD1' ' A' ' 56' ' ' PHE . 0.1 OUTLIER -87.24 -62.79 1.42 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.914 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.78 162.74 16.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.933 0.397 . . . . 0.0 111.214 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.883 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.0 tm? -104.56 143.11 33.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.817 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.883 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -147.1 177.5 25.35 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.451 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.3 m -143.05 171.66 13.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.854 0.359 . . . . 0.0 110.984 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -60.55 -29.23 69.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.93 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.4 t -88.89 -25.23 22.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.042 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.7 -68.2 0.72 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.962 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.401 HD12 ' CD1' ' A' ' 66' ' ' LEU . 22.8 mt -70.14 -39.14 75.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.051 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.312 -0.851 . . . . 0.0 110.873 -179.996 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.823 0.344 . . . . 0.0 111.022 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.66 151.75 19.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.818 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.773 HD11 HD11 ' A' ' 78' ' ' LEU . 1.1 tt -116.01 143.73 45.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.979 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.797 ' HB2' HG22 ' A' ' 77' ' ' ILE . 0.9 OUTLIER -123.6 -177.52 3.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.863 179.97 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -142.1 118.31 10.75 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.837 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -95.47 174.08 7.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.859 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 44.5 mttt -74.21 -41.84 60.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.825 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.1 p -66.66 -31.32 71.92 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.812 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -75.0 -33.86 61.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.833 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -65.0 -38.64 91.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.806 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.569 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 8.9 pttt -81.65 -25.83 35.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.094 0.473 . . . . 0.0 110.994 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.486 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 6.7 m-20 -90.66 -13.45 34.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.068 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.531 ' O ' HD21 ' A' ' 18' ' ' LEU . 20.5 t80 -91.7 -62.04 1.51 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.105 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.09 -43.67 9.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.287 -179.213 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.569 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 28.5 mttm -73.31 -17.08 61.35 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 120.908 -0.317 . . . . 0.0 111.477 -178.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.486 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 21.5 tp -76.79 -37.82 55.11 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.487 -0.561 . . . . 0.0 109.487 179.188 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.83 HD13 ' CB ' ' A' ' 24' ' ' ASP . 0.4 OUTLIER -67.16 -33.08 74.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.853 179.85 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.0 mt -74.9 -35.55 62.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.84 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.39 -22.69 67.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.099 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 133.09 41.03 0.19 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.463 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.405 ' CB ' ' HG ' ' A' ' 17' ' ' LEU . 32.6 t80 -124.04 144.31 49.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.868 0.366 . . . . 0.0 110.861 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.606 ' HB3' HG12 ' A' ' 26' ' ' VAL . 5.0 t0 -69.24 122.55 19.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.017 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.83 ' CB ' HD13 ' A' ' 18' ' ' LEU . 28.4 p-10 -78.94 -27.63 43.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.201 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.8 -56.15 13.46 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.399 -179.476 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.606 HG12 ' HB3' ' A' ' 23' ' ' ASP . 14.5 p -49.37 -28.48 3.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.629 -179.536 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.664 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -72.88 -33.26 65.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.9 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -55.28 -50.72 68.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.002 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -59.17 -23.92 62.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.094 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.527 ' CG1' HD13 ' A' ' 61' ' ' ILE . 91.1 t -77.72 -72.2 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.105 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.405 HG23 ' HG3' ' A' ' 35' ' ' ARG . 1.5 mp -49.37 -27.48 2.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.229 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.64 HD23 ' N ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -67.68 -36.4 80.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.858 179.852 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.64 ' N ' HD23 ' A' ' 32' ' ' LEU . 61.9 m -70.59 -27.62 64.24 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.497 -179.501 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.435 ' CD2' HD11 ' A' ' 40' ' ' LEU . 21.3 mt -90.26 -29.51 18.11 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.669 -179.375 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.577 ' HD2' HD13 ' A' ' 4' ' ' LEU . 10.8 mtp180 -97.09 20.21 11.67 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -179.275 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.495 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.5 OUTLIER -121.38 -55.83 1.92 Allowed 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 121.022 -0.271 . . . . 0.0 111.086 179.746 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.495 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 6.1 pttm 152.04 -20.44 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.036 0.534 . . . . 0.0 110.949 179.605 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.528 ' HB3' HG23 ' A' ' 33' ' ' THR . 1.3 tt0 -63.56 114.79 14.34 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.993 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.53 -179.67 4.32 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.416 2.078 . . . . 0.0 112.146 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.75 HD22 ' SG ' ' A' ' 59' ' ' CYS . 5.5 mp -108.33 142.71 38.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.962 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.06 157.88 74.23 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.107 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.66 -10.02 25.92 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.612 2.208 . . . . 0.0 112.663 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.19 20.6 8.96 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.142 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.538 ' HD2' HD23 ' A' ' 40' ' ' LEU . 8.4 m-30 -104.14 8.48 36.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.218 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 59.42 37.26 23.21 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.875 0.369 . . . . 0.0 110.878 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.3 p-10 -79.26 104.26 9.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.874 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -169.18 176.94 5.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.876 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.31 148.16 48.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.001 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.54 HD21 ' CD ' ' A' ' 58' ' ' GLU . 4.2 mt -96.85 178.78 5.18 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.825 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 11.6 ptpt -112.88 179.27 4.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.986 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 67.1 -145.17 45.94 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.601 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 9.4 mmtm -59.94 -20.45 57.52 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.638 0.256 . . . . 0.0 111.105 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 8.7 m95 -96.81 39.28 1.18 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.992 0.425 . . . . 0.0 110.827 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.44 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.8 OUTLIER -70.19 -49.14 18.66 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.426 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.44 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 86.2 Cg_endo -83.1 37.64 0.68 Allowed 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.572 2.181 . . . . 0.0 113.031 -179.563 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.492 ' CE1' HD21 ' A' ' 79' ' ' LEU . 20.9 m-85 -136.4 172.65 12.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.698 179.651 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 27.0 ttm105 -136.14 135.17 39.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.844 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.54 ' CD ' HD21 ' A' ' 49' ' ' LEU . 1.4 tt0 -96.0 167.63 11.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.892 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.75 ' SG ' HD22 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -166.56 111.93 0.8 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.807 179.927 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.405 ' N ' ' CD2' ' A' ' 60' ' ' HIS . 12.1 m170 -91.29 85.15 5.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.003 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.666 HG13 HD21 ' A' ' 40' ' ' LEU . 3.8 mp -58.51 -29.66 39.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.013 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.41 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 29.2 mttt -139.71 162.81 48.9 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.604 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.41 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 31.3 Cg_endo -63.71 -8.12 14.64 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.312 2.008 . . . . 0.0 112.77 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -133.3 26.52 4.15 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.591 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.878 ' O ' HD23 ' A' ' 66' ' ' LEU . 60.6 t -142.72 145.44 23.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.168 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.878 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.2 OUTLIER -148.46 97.76 2.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.646 179.707 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.762 HD22 ' N ' ' A' ' 68' ' ' VAL . 1.4 tm? -91.79 135.4 33.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.01 0.434 . . . . 0.0 111.1 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.762 ' N ' HD22 ' A' ' 67' ' ' LEU . 97.7 t -108.1 124.89 64.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.889 178.86 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.9 ' CD1' HD11 ' A' ' 76' ' ' LEU . 13.6 p90 -137.27 153.78 50.26 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.224 -179.389 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.719 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.9 OUTLIER -112.55 131.9 55.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.946 -179.997 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.523 HG22 ' N ' ' A' ' 72' ' ' LYS . 8.1 p -78.79 159.67 4.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.062 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.523 ' N ' HG22 ' A' ' 71' ' ' VAL . 3.6 tmtm? -143.66 160.61 40.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.864 179.466 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -40.27 -32.96 0.21 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.773 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.7 p-10 -164.93 30.97 0.06 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.922 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 71.7 mt-10 -153.35 158.34 41.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.868 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.9 HD11 ' CD1' ' A' ' 69' ' ' TYR . 6.0 tp -123.14 137.47 54.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.416 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.797 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.0 pp -127.42 134.67 65.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.424 -179.624 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.773 HD11 HD11 ' A' ' 4' ' ' LEU . 28.2 mt -86.99 124.75 33.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.858 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.519 HD11 ' HB2' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -82.43 -64.74 1.11 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.824 179.96 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.467 ' O ' HD22 ' A' ' 67' ' ' LEU . 0.4 OUTLIER -162.33 171.21 17.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.085 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.699 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.5 tm? -126.26 132.05 51.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.946 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.699 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -143.59 165.46 27.16 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.467 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 17.3 m -104.79 173.95 6.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.724 0.297 . . . . 0.0 110.983 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -64.36 -24.52 67.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.06 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 73.4 m -89.98 -26.83 20.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.08 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -73.91 -68.18 0.54 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.041 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.508 HD12 HD12 ' A' ' 66' ' ' LEU . 17.3 mt -72.15 -32.11 66.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.018 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.899 179.918 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 mp . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.907 0.384 . . . . 0.0 111.007 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.55 172.07 8.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.77 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.9 tt -137.27 153.98 50.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.899 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.76 ' HB2' HG22 ' A' ' 77' ' ' ILE . 2.6 t30 -146.48 176.31 9.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.917 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.3 mt -137.74 131.24 31.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.867 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -103.28 166.06 10.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.915 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.63 -30.88 69.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.886 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.1 m -76.55 -41.73 45.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.863 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.589 ' HE2' HD13 ' A' ' 67' ' ' LEU . 22.5 t80 -71.45 -34.88 70.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.87 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -59.85 -40.71 89.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.802 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.546 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -89.98 -15.31 32.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.276 -179.959 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.457 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 5.0 m-20 -90.36 -11.12 41.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.185 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.697 ' O ' HD13 ' A' ' 18' ' ' LEU . 17.2 t80 -90.74 -67.08 0.87 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.978 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.843 ' HA ' HD22 ' A' ' 18' ' ' LEU . 2.3 m-20 -90.95 -34.37 15.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.163 -179.319 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.546 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -76.44 -19.42 58.08 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.508 -179.127 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.457 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 36.5 tp -82.47 -34.25 28.15 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.843 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.1 OUTLIER -50.98 -48.69 61.14 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.905 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 27.7 mt -90.16 12.86 16.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.467 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -111.09 31.65 5.89 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.878 0.371 . . . . 0.0 110.86 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.01 22.83 22.0 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.473 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.496 ' CD1' HD12 ' A' ' 18' ' ' LEU . 29.4 t80 -117.08 143.91 45.25 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.81 0.338 . . . . 0.0 110.851 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.567 ' HB3' HG23 ' A' ' 26' ' ' VAL . 3.9 t70 -91.92 111.05 22.43 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.856 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.834 ' HA ' HD23 ' A' ' 27' ' ' LEU . 36.2 p-10 -53.89 -27.31 29.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.202 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.8 t -60.73 -19.39 58.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.246 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.567 HG23 ' HB3' ' A' ' 23' ' ' ASP . 21.8 t -88.55 -40.7 13.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.691 0.281 . . . . 0.0 111.486 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.834 HD23 ' HA ' ' A' ' 24' ' ' ASP . 1.2 pp -57.65 -36.48 71.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.118 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -62.78 -28.01 69.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.009 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -75.06 -34.2 61.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.186 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 1.101 HG23 HG21 ' A' ' 61' ' ' ILE . 10.9 p -89.96 -47.29 14.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.395 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.578 HD12 HG13 ' A' ' 30' ' ' VAL . 1.6 mp -58.05 -25.14 25.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.86 0.362 . . . . 0.0 110.707 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.867 HD23 ' N ' ' A' ' 33' ' ' THR . 0.2 OUTLIER -70.52 -52.5 21.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.27 -179.721 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.867 ' N ' HD23 ' A' ' 32' ' ' LEU . 89.3 m -66.56 -23.97 66.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.918 -179.349 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.579 HD21 HD21 ' A' ' 40' ' ' LEU . 76.2 mt -89.95 -33.61 16.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.756 0.312 . . . . 0.0 111.591 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.1 mtt180 -98.81 20.22 13.48 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -179.301 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.51 ' O ' ' HB3' ' A' ' 37' ' ' LYS . 4.0 mtmt -108.69 -55.88 2.34 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.033 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.51 ' HB3' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 150.83 -20.38 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.122 0.569 . . . . 0.0 110.801 179.622 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.62 126.36 89.48 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.605 -0.27 . . . . 0.0 110.987 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -75.08 169.41 22.65 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.449 2.099 . . . . 0.0 112.278 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.579 HD21 HD21 ' A' ' 34' ' ' LEU . 4.6 mt -95.82 126.09 40.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.802 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.407 ' HB2' ' CE1' ' A' ' 44' ' ' PHE . 5.4 m-20 -72.26 162.16 75.21 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.055 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -68.89 -27.54 30.65 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.609 2.206 . . . . 0.0 112.304 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -64.76 -15.54 61.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.326 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.407 ' CE1' ' HB2' ' A' ' 41' ' ' ASP . 24.6 m-85 -79.17 -0.19 30.85 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.57 -0.287 . . . . 0.0 111.552 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 67.83 48.56 1.01 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.959 0.409 . . . . 0.0 110.843 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.2 p-10 -88.92 89.02 7.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.772 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' HIS . . . . . 0.405 ' HA ' ' NH1' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -151.48 -179.88 7.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.044 -179.796 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -84.46 125.08 32.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.112 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 90.0 mt -72.3 -178.57 2.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.898 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -110.15 172.75 6.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.928 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 78.21 -117.96 4.8 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.587 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.2 mttm -89.63 -18.03 27.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.578 0.228 . . . . 0.0 111.298 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 16.5 m-90 -96.18 38.26 1.2 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.805 0.336 . . . . 0.0 111.083 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.435 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 5.0 mtpt -83.96 -50.92 0.62 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.042 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 17.0 Cg_exo -66.62 -8.84 22.29 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.505 2.137 . . . . 0.0 112.475 179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.599 ' HA ' HD12 ' A' ' 70' ' ' LEU . 13.1 m-85 -105.75 -171.64 1.94 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.904 0.383 . . . . 0.0 111.066 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.405 ' NH1' ' HA ' ' A' ' 47' ' ' HIS . 4.1 ttm-85 -138.92 136.22 35.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.847 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.454 ' OE2' HD22 ' A' ' 87' ' ' LEU . 6.9 tp10 -106.19 162.79 13.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.114 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.559 ' SG ' HD13 ' A' ' 40' ' ' LEU . 3.1 t -162.71 117.45 1.78 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.906 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -90.28 89.47 7.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.932 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 1.101 HG21 HG23 ' A' ' 30' ' ' VAL . 4.0 mp -60.53 -31.4 48.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.069 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.5 mttm -141.42 172.86 5.45 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.765 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -66.78 -6.35 15.42 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.706 2.27 . . . . 0.0 112.663 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -142.27 26.09 1.84 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.879 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.616 ' C ' HD23 ' A' ' 66' ' ' LEU . 64.5 t -141.06 140.85 32.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.184 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.616 HD23 ' C ' ' A' ' 65' ' ' VAL . 0.0 OUTLIER -159.14 110.3 2.06 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.759 179.863 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.589 HD13 ' HE2' ' A' ' 10' ' ' PHE . 0.2 OUTLIER -108.3 131.8 54.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.712 -179.973 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.448 ' O ' HD12 ' A' ' 67' ' ' LEU . 41.5 t -88.68 140.45 15.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.98 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.414 ' CE2' ' HB2' ' A' ' 59' ' ' CYS . 2.6 p90 -146.77 159.36 43.6 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.918 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.778 ' HB2' HD11 ' A' ' 77' ' ' ILE . 2.8 tp -109.24 171.98 7.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.856 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 28.7 t -123.26 103.71 13.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.181 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.06 168.37 10.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.743 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -58.76 104.04 0.2 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.832 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 57.0 22.05 6.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.122 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -148.68 138.21 21.95 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.748 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.7 tp -108.03 143.93 36.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.933 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.778 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.2 pp -131.64 130.26 62.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.201 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.403 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 74.9 mt -76.28 135.4 39.62 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.747 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.36 -62.68 1.29 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.137 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.69 164.59 18.99 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.931 0.396 . . . . 0.0 111.472 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.612 ' C ' HD13 ' A' ' 81' ' ' LEU . 3.1 tm? -125.19 126.73 45.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.598 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.447 ' HA3' HD11 ' A' ' 87' ' ' LEU . . . -146.31 -174.9 18.86 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.557 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 22.7 m -110.55 174.46 5.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.91 0.386 . . . . 0.0 111.031 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.33 -25.3 65.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.981 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 69.6 m -86.93 -15.97 37.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.281 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -86.79 -69.28 0.69 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.02 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.464 ' H ' HD12 ' A' ' 87' ' ' LEU . 6.5 mp -63.15 -41.23 99.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.079 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.208 -0.901 . . . . 0.0 110.958 179.961 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.89 HD13 ' HB2' ' A' ' 76' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.775 0.322 . . . . 0.0 110.917 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.9 151.32 47.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.892 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.2 tt -121.21 154.38 36.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.83 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.715 ' HB2' HG22 ' A' ' 77' ' ' ILE . 0.7 OUTLIER -147.54 155.81 42.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.901 179.978 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.9 mp -124.78 126.78 46.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.976 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -100.52 158.97 15.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.957 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.3 tttm -61.26 -31.74 71.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.899 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 6.6 m -66.1 -28.96 69.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.032 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.692 ' HE1' HD13 ' A' ' 67' ' ' LEU . 55.7 t80 -73.87 -32.4 63.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.134 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -79.29 -30.08 42.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.056 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.03 -16.2 30.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.387 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -81.74 -30.48 32.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.639 0.257 . . . . 0.0 111.148 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.887 ' CE2' HD13 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -90.42 -53.02 4.62 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 179.538 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.604 ' HA ' HD22 ' A' ' 18' ' ' LEU . 11.9 m-20 -51.48 -34.47 35.84 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.06 0.457 . . . . 0.0 110.074 178.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.54 -27.98 37.42 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.097 179.044 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.2 mt -76.12 -41.5 49.92 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.1 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.604 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.0 OUTLIER -54.13 -33.18 57.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.992 179.914 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 mt -90.06 -5.86 56.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.617 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.64 38.01 1.24 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.846 0.355 . . . . 0.0 111.068 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.67 26.71 41.27 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.502 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.516 ' CD1' HD12 ' A' ' 18' ' ' LEU . 10.6 t80 -119.51 128.39 53.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.814 0.34 . . . . 0.0 110.88 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.41 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 8.0 t70 -84.85 131.28 34.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.996 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.7 p-10 -56.9 -21.8 32.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.099 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.6 t -48.15 -53.45 16.69 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.821 0.343 . . . . 0.0 110.955 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.42 ' HB ' ' CZ ' ' A' ' 22' ' ' PHE . 39.2 t -65.14 -35.11 74.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.669 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.887 HD13 ' CE2' ' A' ' 14' ' ' PHE . 1.1 tp -59.14 -33.52 70.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.669 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -59.35 -47.09 86.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.912 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -63.14 -40.06 96.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.932 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 94.6 t -66.27 -72.46 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.09 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.796 HD13 ' CD1' ' A' ' 27' ' ' LEU . 1.2 mp -45.76 -33.45 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 121.152 0.501 . . . . 0.0 110.523 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.839 HD23 ' N ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -55.51 -59.97 4.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.17 179.35 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.839 ' N ' HD23 ' A' ' 32' ' ' LEU . 64.6 m -54.34 -24.45 19.39 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.307 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 31' ' ' ILE . 17.7 mt -73.36 -62.08 1.6 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.844 0.354 . . . . 0.0 110.961 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.4 mtp180 -67.9 -49.0 64.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.029 0.442 . . . . 0.0 110.921 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.617 ' HE2' HD21 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -68.55 -13.77 62.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.533 179.882 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.547 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 1.3 pttm 52.59 70.73 0.54 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.679 -179.549 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.699 ' HB3' HG23 ' A' ' 33' ' ' THR . 1.3 tm-20 -81.56 142.48 49.84 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.636 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -61.32 104.8 0.31 Allowed 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.366 2.044 . . . . 0.0 112.135 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.445 HD22 ' CD2' ' A' ' 44' ' ' PHE . 57.3 mt -68.3 137.61 54.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.99 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -87.29 158.42 52.19 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.82 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.32 -26.72 63.65 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.504 2.136 . . . . 0.0 112.224 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -67.68 -21.46 65.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.094 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.445 ' CD2' HD22 ' A' ' 40' ' ' LEU . 3.2 m-85 -56.5 -27.64 57.75 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.003 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 63.29 61.33 1.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.939 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.0 p-10 -91.45 77.35 5.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.871 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -125.89 -175.29 3.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.043 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.07 166.97 21.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.253 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.572 HD12 ' N ' ' A' ' 49' ' ' LEU . 1.0 OUTLIER -104.44 -167.55 1.37 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.885 179.883 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -126.1 151.38 47.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.864 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 92.12 -136.03 13.03 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.564 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.22 -11.81 61.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.614 0.245 . . . . 0.0 111.352 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 17.3 m-90 -96.69 39.33 1.17 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.969 0.414 . . . . 0.0 111.007 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.508 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 2.4 ttmm -72.71 -50.25 7.62 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.468 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.508 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 63.1 Cg_endo -74.43 0.43 8.61 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.336 2.024 . . . . 0.0 112.932 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.447 ' CD1' HD13 ' A' ' 70' ' ' LEU . 39.4 m-85 -102.83 179.78 4.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.808 0.337 . . . . 0.0 110.817 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.42 ' NH1' HG21 ' A' ' 71' ' ' VAL . 12.1 ttm180 -147.14 134.39 20.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.833 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.5 ' HG3' HG22 ' A' ' 68' ' ' VAL . 4.0 tt0 -95.85 162.93 13.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.002 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.433 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 21.6 t -163.87 105.91 0.93 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.847 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.434 ' CD2' ' N ' ' A' ' 60' ' ' HIS . 6.8 m170 -84.79 94.96 8.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.955 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.547 HD11 ' HB3' ' A' ' 67' ' ' LEU . 4.4 mp -66.09 -25.22 35.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.913 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.43 169.96 10.67 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.766 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -70.86 1.2 5.4 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.798 2.332 . . . . 0.0 112.866 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -144.38 24.06 1.6 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.845 0.355 . . . . 0.0 110.778 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.813 ' O ' HD23 ' A' ' 66' ' ' LEU . 41.4 t -136.49 153.13 30.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.919 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.813 HD23 ' O ' ' A' ' 65' ' ' VAL . 3.7 mt -145.56 112.27 5.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.775 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.742 HD12 ' N ' ' A' ' 68' ' ' VAL . 4.7 tp -106.66 128.74 54.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.018 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.742 ' N ' HD12 ' A' ' 67' ' ' LEU . 66.9 t -108.4 134.16 51.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.753 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.433 ' CE2' ' HB2' ' A' ' 59' ' ' CYS . 2.8 p90 -144.07 165.43 27.81 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.886 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.466 ' HB2' HD11 ' A' ' 77' ' ' ILE . 8.3 tp -100.24 157.53 16.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.871 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.42 HG21 ' NH1' ' A' ' 57' ' ' ARG . 21.4 t -113.31 103.82 16.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.116 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.9 tttp -83.17 161.74 21.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.719 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -44.02 -35.87 2.27 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.443 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.0 p-10 -156.0 29.66 0.36 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.82 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -152.5 156.6 39.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.814 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.89 ' HB2' HD13 ' A' ' 2' ' ' LEU . 11.8 tp -119.67 139.92 51.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.715 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.715 HG22 ' HB2' ' A' ' 5' ' ' ASN . 1.8 pp -133.35 127.95 54.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.212 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.43 HD22 HD21 ' A' ' 67' ' ' LEU . 58.9 mt -70.22 139.81 52.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.95 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.32 -73.72 0.65 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.058 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.08 174.61 13.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.875 0.369 . . . . 0.0 111.364 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.897 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.1 tm? -120.93 140.65 51.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.838 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.897 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -147.13 -176.85 21.2 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.572 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.1 t -139.81 -172.03 3.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.818 0.342 . . . . 0.0 110.912 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.8 t-160 -72.63 -28.66 62.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.965 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.01 -23.06 21.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.088 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -85.74 -71.12 0.55 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.874 0.368 . . . . 0.0 111.003 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.529 HD12 ' CD1' ' A' ' 66' ' ' LEU . 72.6 mt -60.45 -40.66 91.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.992 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.175 -0.917 . . . . 0.0 110.976 179.946 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.3 mt . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.897 0.38 . . . . 0.0 110.857 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.42 142.37 55.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.781 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.555 HD12 HD23 ' A' ' 76' ' ' LEU . 7.7 tp -114.03 154.45 27.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.013 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.719 ' HB2' HG22 ' A' ' 77' ' ' ILE . 2.0 t30 -138.9 176.04 9.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.832 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.0 mt -138.9 129.06 25.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.997 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 25.8 mmtm -97.21 -177.45 3.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.784 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.83 -33.85 39.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.924 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.6 m -74.59 -34.34 62.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.016 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.473 ' HE1' HD13 ' A' ' 67' ' ' LEU . 36.0 t80 -61.16 -29.22 69.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.075 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -71.55 -42.39 67.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.02 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.549 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 2.6 mtmm -78.54 -19.51 52.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.284 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.406 ' C ' ' HB2' ' A' ' 17' ' ' LEU . 20.7 m-20 -90.4 -10.39 44.05 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.095 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.536 ' O ' HD21 ' A' ' 18' ' ' LEU . 6.7 t80 -91.17 -66.03 0.96 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.801 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -91.46 -37.73 12.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.89 -0.595 . . . . 0.0 112.15 -179.467 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.549 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -75.49 -18.27 59.89 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 120.941 -0.304 . . . . 0.0 111.677 -178.799 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.43 HD11 ' HG3' ' A' ' 86' ' ' GLU . 1.2 tt -79.81 -34.1 39.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.977 0.418 . . . . 0.0 109.891 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.782 HD13 ' HB3' ' A' ' 24' ' ' ASP . 0.8 OUTLIER -66.65 -33.82 76.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.799 179.641 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.9 mt -80.57 -36.05 33.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.911 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -57.61 -22.73 47.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.086 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.98 36.7 0.27 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.687 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.406 ' CE2' ' O ' ' A' ' 23' ' ' ASP . 75.0 t80 -122.11 163.3 19.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.72 0.295 . . . . 0.0 110.951 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.406 ' O ' ' CE2' ' A' ' 22' ' ' PHE . 9.9 t70 -86.31 123.08 31.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.941 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.782 ' HB3' HD13 ' A' ' 18' ' ' LEU . 9.4 p-10 -77.85 -31.61 51.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.985 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.0 t -60.86 -40.79 94.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.35 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 45.3 t -58.66 -37.99 68.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.341 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.562 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.6 OUTLIER -60.83 -33.58 73.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.975 -179.885 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.412 ' N ' ' HG ' ' A' ' 27' ' ' LEU . 5.6 t30 -58.36 -29.0 65.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.122 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -72.04 -44.39 63.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.031 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.645 HG13 HD12 ' A' ' 31' ' ' ILE . 10.8 p -80.13 -46.15 22.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.148 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.645 HD12 HG13 ' A' ' 30' ' ' VAL . 1.6 mp -58.42 -29.96 39.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.921 0.391 . . . . 0.0 110.657 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.448 HD23 ' C ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -67.1 -24.7 65.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.166 -179.791 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 51.4 m -90.21 -24.0 21.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.568 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.0 mt -90.11 -38.8 13.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.593 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.566 ' CD ' HG23 ' A' ' 31' ' ' ILE . 51.9 mtp85 -90.56 20.15 4.81 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -179.292 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.479 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 2.2 mttm -110.98 -55.76 2.45 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 121.106 -0.238 . . . . 0.0 111.012 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.479 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 155.65 -20.5 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.109 179.669 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -78.24 113.05 30.31 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.152 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -74.58 -179.55 4.95 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.545 2.163 . . . . 0.0 112.108 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.47 HD13 ' SG ' ' A' ' 59' ' ' CYS . 15.6 mt -87.78 116.1 25.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.822 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -60.9 159.38 27.21 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.999 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.46 -9.34 25.03 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.602 2.201 . . . . 0.0 112.574 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.14 8.95 24.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.293 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -92.39 11.7 25.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.658 0.266 . . . . 0.0 111.294 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 60.93 32.05 19.98 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.803 0.335 . . . . 0.0 110.984 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -69.26 98.61 1.06 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.81 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -144.27 177.17 8.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.888 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.53 129.82 34.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.135 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.401 HD11 ' HG3' ' A' ' 58' ' ' GLU . 21.8 mt -72.63 -178.93 2.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.868 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.3 mtmt -120.36 169.72 10.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.924 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 79.12 -118.25 4.74 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.492 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.53 -21.75 30.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.663 0.268 . . . . 0.0 111.221 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 6.2 m95 -96.27 38.71 1.18 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.848 0.356 . . . . 0.0 110.885 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.438 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 11.6 ttmt -73.77 -51.29 5.26 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.237 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.438 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 89.2 Cg_endo -79.77 47.1 2.41 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.307 2.005 . . . . 0.0 112.481 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.419 ' HA ' HD11 ' A' ' 70' ' ' LEU . 96.7 m-85 -157.65 175.92 13.29 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.868 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.568 ' O ' HG13 ' A' ' 68' ' ' VAL . 4.3 ttm180 -130.96 134.39 46.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.853 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.401 ' HG3' HD11 ' A' ' 49' ' ' LEU . 2.6 tm-20 -104.83 167.64 9.59 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.982 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.47 ' SG ' HD13 ' A' ' 40' ' ' LEU . 6.3 t -171.1 115.4 0.42 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.659 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.418 ' CG ' ' O ' ' A' ' 60' ' ' HIS . 12.2 p80 -93.33 109.55 21.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.058 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.49 HD12 ' N ' ' A' ' 61' ' ' ILE . 4.3 mp -77.92 -27.68 15.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.754 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.43 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 12.6 mtpp -133.18 168.94 15.4 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.6 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.43 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 14.8 Cg_exo -68.72 -0.3 5.89 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.634 2.222 . . . . 0.0 113.015 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -144.47 27.61 1.37 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.811 0.338 . . . . 0.0 110.801 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.809 ' O ' HD23 ' A' ' 66' ' ' LEU . 48.3 t -136.38 148.72 27.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.037 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.809 HD23 ' O ' ' A' ' 65' ' ' VAL . 2.0 mt -147.06 93.24 2.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.78 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.622 HD12 ' N ' ' A' ' 68' ' ' VAL . 3.2 tp -93.81 120.45 34.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.85 -179.785 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.622 ' N ' HD12 ' A' ' 67' ' ' LEU . 47.7 t -94.32 135.35 28.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.04 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.879 ' CD1' HD11 ' A' ' 76' ' ' LEU . 29.6 p90 -147.36 168.2 22.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.101 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.741 ' HB2' HD11 ' A' ' 77' ' ' ILE . 1.6 tp -122.18 143.36 49.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.694 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -102.07 99.15 7.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.246 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.416 ' O ' ' C ' ' A' ' 73' ' ' ASP . 0.0 OUTLIER -77.44 167.09 22.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.72 179.883 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.416 ' C ' ' O ' ' A' ' 72' ' ' LYS . 1.2 p30 -30.04 -60.75 0.17 Allowed 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.196 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -143.67 30.82 1.33 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.789 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -154.51 109.44 3.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.194 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.879 HD11 ' CD1' ' A' ' 69' ' ' TYR . 1.6 tp -70.32 141.82 52.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.79 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.741 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.1 pp -129.8 136.54 58.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.321 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.465 HD11 HD21 ' A' ' 4' ' ' LEU . 82.0 mt -79.41 137.88 37.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.835 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.438 HD12 ' HD2' ' A' ' 80' ' ' ARG . 0.2 OUTLIER -96.92 -72.8 0.63 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.959 179.968 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.438 ' HD2' HD12 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -158.16 174.01 15.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.191 179.953 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.607 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.3 tm? -120.04 131.76 55.23 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.746 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.607 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -145.4 -174.82 17.97 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.545 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 20.0 m -152.55 -173.31 4.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.905 0.383 . . . . 0.0 110.805 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 -65.72 -30.57 71.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.854 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 55.9 m -89.91 -30.27 17.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.94 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.43 ' HG3' HD11 ' A' ' 17' ' ' LEU . 1.9 mm-40 -74.77 -73.39 0.24 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.943 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.426 HD12 HD12 ' A' ' 66' ' ' LEU . 33.9 mt -65.64 -34.19 77.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.842 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.946 179.983 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 20.0 mt . . . . . 0 N--CA 1.457 -0.104 0 CA-C-O 120.829 0.347 . . . . 0.0 110.935 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.45 151.48 20.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.815 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.1 tp -116.49 148.75 40.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.852 0.358 . . . . 0.0 111.051 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.496 ' HB2' HG22 ' A' ' 77' ' ' ILE . 5.9 t30 -140.67 -179.13 5.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.823 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.429 HD21 ' NH2' ' A' ' 35' ' ' ARG . 3.1 mp -144.62 143.69 30.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.929 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.6 mmtt -114.88 -177.92 3.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.906 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.46 -31.46 67.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.812 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.84 -33.59 68.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.928 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.484 ' CZ ' HD13 ' A' ' 78' ' ' LEU . 41.1 t80 -80.06 -32.13 39.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.938 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -59.94 -38.56 82.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.906 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.558 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 2.7 pttp -86.27 -22.68 26.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.165 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -90.7 -10.43 43.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.241 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.701 ' O ' HD13 ' A' ' 18' ' ' LEU . 93.9 t80 -90.58 -67.46 0.85 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.16 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.827 ' HA ' HD22 ' A' ' 18' ' ' LEU . 0.5 OUTLIER -91.0 -31.46 16.31 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -179.21 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.558 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -77.91 -26.52 49.1 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.482 -179.07 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.54 -31.34 60.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.92 0.39 . . . . 0.0 110.17 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.827 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.2 OUTLIER -55.68 -43.3 76.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.045 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.455 ' O ' HD12 ' A' ' 19' ' ' LEU . 4.0 pp -90.11 15.02 10.95 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.494 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -113.64 33.1 5.36 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.795 0.331 . . . . 0.0 110.813 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.55 27.08 23.38 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.304 -179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.455 ' CD1' ' N ' ' A' ' 23' ' ' ASP . 14.3 t80 -115.2 149.7 37.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.83 0.348 . . . . 0.0 110.824 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.455 ' N ' ' CD1' ' A' ' 22' ' ' PHE . 46.2 t0 -92.52 98.75 11.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.91 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -54.06 -30.21 47.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.244 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.4 m -58.88 -26.22 64.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.161 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.47 ' O ' HG23 ' A' ' 30' ' ' VAL . 38.3 t -84.6 -36.47 11.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.299 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.579 ' CD2' HD21 ' A' ' 18' ' ' LEU . 0.2 OUTLIER -55.53 -35.8 66.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.85 -179.925 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.448 ' O ' ' HB3' ' A' ' 32' ' ' LEU . 8.7 t-20 -53.41 -66.09 0.45 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.172 -179.678 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -46.9 -28.57 1.64 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.484 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 26' ' ' VAL . 37.9 t -75.37 -69.59 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.306 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.1 mp -55.97 -24.38 17.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.082 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.487 HD23 ' C ' ' A' ' 32' ' ' LEU . 0.1 OUTLIER -71.23 -21.17 62.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.97 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.6 m -90.0 -33.55 16.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.881 0.372 . . . . 0.0 111.464 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.774 HD21 HD21 ' A' ' 40' ' ' LEU . 14.1 mt -90.17 -26.33 20.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.786 -179.451 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.429 ' NH2' HD21 ' A' ' 6' ' ' LEU . 26.6 mtt180 -99.01 20.29 13.57 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -179.138 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.459 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 2.7 mtmt -116.47 -55.63 2.36 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.92 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.459 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 157.45 -20.55 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.161 179.665 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -63.84 110.64 4.01 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.069 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.43 166.89 25.65 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.399 2.066 . . . . 0.0 112.235 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.774 HD21 HD21 ' A' ' 34' ' ' LEU . 8.5 mt -94.71 123.25 38.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.977 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -68.2 156.86 89.06 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.934 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.33 -8.8 24.48 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.678 2.252 . . . . 0.0 112.512 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -89.48 12.01 17.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.395 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -98.89 14.23 29.74 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.711 0.291 . . . . 0.0 111.249 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 56.02 36.08 26.72 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.856 0.36 . . . . 0.0 111.064 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -82.56 90.45 6.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.902 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -138.62 -178.38 5.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.873 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.36 142.03 32.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.213 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.655 HD12 ' HB3' ' A' ' 53' ' ' TRP . 15.3 mt -83.62 -172.25 4.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.798 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.8 mmtt -116.57 163.12 16.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.975 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.82 -136.07 18.2 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.52 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.5 mmpt? -67.22 -18.24 65.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.566 0.222 . . . . 0.0 111.225 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.655 ' HB3' HD12 ' A' ' 49' ' ' LEU . 5.3 m-90 -96.45 31.93 2.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.741 0.305 . . . . 0.0 111.154 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 3.0 mttt -79.63 -51.38 1.19 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.911 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 23.7 Cg_exo -63.76 -11.81 28.46 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.514 2.143 . . . . 0.0 112.234 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.686 ' HD1' HD13 ' A' ' 70' ' ' LEU . 73.1 m-85 -105.17 171.87 7.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.813 0.339 . . . . 0.0 110.973 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.0 ttp85 -125.73 154.35 42.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.837 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.514 ' HB2' HD21 ' A' ' 49' ' ' LEU . 0.2 OUTLIER -117.79 162.22 18.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.054 -179.969 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.633 ' SG ' HD13 ' A' ' 40' ' ' LEU . 38.0 t -150.65 145.33 25.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.803 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.448 ' CE1' HD22 ' A' ' 66' ' ' LEU . 9.9 m170 -116.49 87.19 2.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.944 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.616 ' H ' HD12 ' A' ' 61' ' ' ILE . 5.3 mp -60.01 -28.28 40.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.936 0.398 . . . . 0.0 110.645 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.454 ' HB2' ' CD ' ' A' ' 63' ' ' PRO . 1.3 ptmm? -160.38 169.65 9.82 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.331 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.454 ' CD ' ' HB2' ' A' ' 62' ' ' LYS . 16.7 Cg_exo -67.93 5.8 0.99 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.697 2.264 . . . . 0.0 113.662 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -139.86 26.14 2.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.55 0.214 . . . . 0.0 111.326 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.815 ' O ' HD23 ' A' ' 66' ' ' LEU . 47.2 t -155.6 149.32 11.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.931 0.396 . . . . 0.0 111.506 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.815 HD23 ' O ' ' A' ' 65' ' ' VAL . 4.2 mt -146.82 117.33 7.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.663 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.675 HD22 ' N ' ' A' ' 68' ' ' VAL . 1.5 tm? -107.22 131.79 53.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.906 0.384 . . . . 0.0 111.189 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.675 ' N ' HD22 ' A' ' 67' ' ' LEU . 71.3 t -105.62 118.6 53.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.811 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.488 ' CD2' HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -133.64 -179.24 5.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.473 -179.296 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.686 HD13 ' HD1' ' A' ' 56' ' ' PHE . 7.2 tp -125.72 169.36 12.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.826 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.6 t -121.02 100.48 9.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.255 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.542 ' HD2' HG23 ' A' ' 77' ' ' ILE . 0.0 OUTLIER -75.85 163.63 27.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.549 179.926 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -43.18 -36.91 1.89 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.416 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -154.13 25.68 0.48 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.836 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 75.1 mt-10 -149.41 173.39 13.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.876 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.488 HD21 ' CD2' ' A' ' 69' ' ' TYR . 0.4 OUTLIER -128.53 144.61 51.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.5 179.593 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.55 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.0 pp -132.31 132.02 60.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.431 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.484 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 73.6 mt -80.62 125.92 30.61 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.643 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.558 HD11 ' CE1' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -87.74 -63.85 1.24 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.093 -179.759 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.526 ' O ' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -159.67 169.42 23.77 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.031 0.444 . . . . 0.0 111.381 179.775 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.889 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.2 tm? -119.79 141.06 49.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.75 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.889 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -157.03 -165.71 15.41 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.597 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 49.2 m -149.89 -175.48 5.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.787 0.327 . . . . 0.0 110.903 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 62.0 t-80 -68.51 -29.44 68.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.077 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.3 m -90.01 -23.67 21.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.187 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.11 -74.35 0.38 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.934 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 16.0 mt -68.39 -41.33 80.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.936 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.926 -179.958 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.8 mt . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.87 0.367 . . . . 0.0 110.857 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.18 148.23 36.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.828 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.648 HD11 HD11 ' A' ' 78' ' ' LEU . 9.1 tt -121.56 154.88 36.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.981 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.731 ' HB2' HG22 ' A' ' 77' ' ' ILE . 5.4 t30 -140.4 171.23 14.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.79 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.9 mp -139.68 129.3 24.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.991 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.4 169.46 8.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.847 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -29.92 67.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.002 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.2 m -77.11 -56.52 4.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.008 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.437 ' CZ ' HD13 ' A' ' 78' ' ' LEU . 62.7 t80 -58.16 -33.58 69.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.048 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -61.26 -42.85 99.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.086 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.578 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 14.0 mttm -90.13 -16.59 29.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.565 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.405 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 1.8 m-20 -90.78 -11.17 40.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.496 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.652 ' O ' HD13 ' A' ' 18' ' ' LEU . 25.4 t80 -90.84 -67.56 0.84 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.206 -179.596 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.789 ' HA ' HD22 ' A' ' 18' ' ' LEU . 28.4 t0 -90.84 -33.13 15.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.312 -0.404 . . . . 0.0 112.082 -179.313 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.578 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 2.9 mttt -74.53 -28.04 60.8 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.948 -179.418 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.405 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 30.6 tp -70.92 -35.77 72.39 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.159 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.789 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.1 OUTLIER -57.99 -33.17 68.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.66 179.812 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 mt -90.05 -6.86 55.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.435 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -96.07 27.15 3.77 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.713 0.292 . . . . 0.0 111.215 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.71 23.03 19.5 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.73 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.46 ' CD1' HD12 ' A' ' 18' ' ' LEU . 11.8 t80 -116.61 122.99 46.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.871 0.367 . . . . 0.0 110.774 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.424 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 14.6 t0 -66.65 128.84 37.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.898 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.862 ' HA ' HD23 ' A' ' 27' ' ' LEU . 7.8 p-10 -78.1 -3.2 41.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.517 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.2 t -82.15 -27.32 32.8 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.685 0.279 . . . . 0.0 111.106 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.3 t -80.57 -36.65 16.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.439 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.862 HD23 ' HA ' ' A' ' 24' ' ' ASP . 2.0 pp -57.1 -37.37 71.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.056 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -57.76 -24.09 55.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.204 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -78.61 -35.37 45.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.112 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.742 HG21 HG11 ' A' ' 65' ' ' VAL . 11.5 p -90.1 -43.49 14.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.226 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.583 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -58.39 -33.04 46.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.772 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.738 HD23 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -60.06 -56.64 19.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.641 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.738 ' N ' HD23 ' A' ' 32' ' ' LEU . 85.0 m -55.59 -24.05 30.69 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.378 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.547 HD12 ' HA ' ' A' ' 31' ' ' ILE . 16.1 mt -86.61 -34.4 19.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.759 0.314 . . . . 0.0 111.214 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -103.75 20.15 18.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.436 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.444 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 0.7 OUTLIER -116.14 21.12 13.93 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 -179.708 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.405 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 4.4 ptmm? 44.01 31.23 0.49 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.481 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -93.86 135.44 24.88 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.897 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -74.84 138.07 22.96 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.499 2.133 . . . . 0.0 112.284 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 33.4 mt -90.2 125.44 35.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.797 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -69.22 155.25 93.93 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.839 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -68.68 -10.24 28.5 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.557 2.171 . . . . 0.0 112.532 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.3 7.5 25.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.438 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -92.98 13.91 19.26 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.599 0.238 . . . . 0.0 111.229 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 58.04 41.23 24.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.88 0.371 . . . . 0.0 111.041 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -86.93 111.79 21.16 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.98 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 11.7 m80 -164.72 -178.35 5.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.907 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -87.18 156.47 19.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.083 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.482 HD11 ' CD ' ' A' ' 58' ' ' GLU . 78.0 mt -109.02 176.92 4.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.934 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -124.8 152.65 43.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.876 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 60.91 111.11 0.01 OUTLIER Glycine 0 CA--C 1.508 -0.37 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.531 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 70.38 -44.27 0.57 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.748 0.309 . . . . 0.0 110.878 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 3.4 m0 -104.55 36.24 2.48 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.9 0.381 . . . . 0.0 110.915 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.445 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.1 OUTLIER -74.54 -49.95 4.76 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.159 -179.949 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.445 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 96.0 Cg_endo -84.7 28.99 0.55 Allowed 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.704 2.27 . . . . 0.0 113.018 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.402 ' CD1' ' O ' ' A' ' 55' ' ' PRO . 24.2 m-85 -139.8 170.42 15.92 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.742 0.306 . . . . 0.0 110.832 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.441 ' O ' HG13 ' A' ' 68' ' ' VAL . 24.6 ttm180 -128.73 139.24 52.31 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.996 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.482 ' CD ' HD11 ' A' ' 49' ' ' LEU . 0.8 OUTLIER -97.61 173.19 7.26 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.804 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -169.55 109.95 0.44 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.834 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.416 ' CD2' HD22 ' A' ' 66' ' ' LEU . 9.0 m170 -87.15 78.42 8.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.853 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.671 HD11 ' HB3' ' A' ' 67' ' ' LEU . 3.4 mp -58.26 -50.97 76.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.034 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.504 ' HD3' HG22 ' A' ' 61' ' ' ILE . 2.3 mmmt -115.98 171.73 4.4 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.729 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.428 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 14.3 Cg_exo -68.81 -2.19 9.02 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.681 2.254 . . . . 0.0 112.947 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -145.85 29.49 1.1 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.823 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.804 ' O ' HD23 ' A' ' 66' ' ' LEU . 47.9 t -139.47 147.39 24.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.217 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.804 HD23 ' O ' ' A' ' 65' ' ' VAL . 2.0 mt -147.35 92.15 2.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.777 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.671 ' HB3' HD11 ' A' ' 61' ' ' ILE . 3.3 tm? -85.15 131.78 34.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.979 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.643 ' N ' HD13 ' A' ' 67' ' ' LEU . 96.9 t -109.84 116.05 51.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.042 179.046 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.599 ' CE2' HD11 ' A' ' 76' ' ' LEU . 21.7 p90 -134.33 156.35 48.62 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.233 -179.291 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.782 ' HB2' HD11 ' A' ' 77' ' ' ILE . 4.3 tp -111.74 -179.79 3.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.891 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.0 t -130.34 108.12 15.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.095 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.68 173.89 6.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.869 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -59.59 102.78 0.16 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.888 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 55.78 25.53 8.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.101 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 84.8 mt-10 -153.43 130.34 10.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.855 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.599 HD11 ' CE2' ' A' ' 69' ' ' TYR . 0.5 OUTLIER -97.31 142.64 28.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.77 179.862 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.782 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.2 pp -129.26 136.29 59.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.305 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.648 HD11 HD11 ' A' ' 4' ' ' LEU . 70.6 mt -87.73 132.23 34.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.645 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.74 -61.29 1.75 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.093 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.409 ' NH2' HG21 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -172.99 162.89 4.72 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.921 0.391 . . . . 0.0 111.358 -179.982 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.569 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.5 tm? -115.36 131.25 56.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.845 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.569 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -139.15 -162.08 8.98 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.498 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 95.7 p -147.8 169.62 19.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.865 0.364 . . . . 0.0 110.819 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -59.42 -28.95 67.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.962 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 18.4 m -90.11 -20.97 22.51 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.183 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -88.52 -75.0 0.44 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.09 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.703 HD12 ' HB2' ' A' ' 66' ' ' LEU . 46.2 mt -56.97 -41.99 79.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.227 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.255 -0.879 . . . . 0.0 111.025 179.998 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 11.6 mt . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.796 0.331 . . . . 0.0 110.838 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.82 138.29 58.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.829 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.416 HD23 ' N ' ' A' ' 5' ' ' ASN . 8.5 tt -116.0 154.68 29.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.927 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.709 ' HB2' HG22 ' A' ' 77' ' ' ILE . 6.6 t30 -135.8 172.41 13.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.827 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.4 mp -139.7 123.13 17.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.918 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -98.55 160.25 14.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.8 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.8 tttp -59.72 -34.87 73.47 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.884 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.38 -25.08 63.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.026 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.404 ' HA ' ' OD2' ' A' ' 13' ' ' ASP . 36.1 t80 -85.34 -33.9 21.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.979 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -58.73 -31.63 68.48 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.086 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.458 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 11.0 mtpp -90.34 -5.23 56.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.857 -179.597 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.457 ' HB2' ' HB3' ' A' ' 81' ' ' LEU . 17.1 p30 -90.69 -17.46 26.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.808 0.337 . . . . 0.0 111.466 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.802 ' CE2' HD13 ' A' ' 27' ' ' LEU . 30.2 t80 -91.18 -66.77 0.9 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.309 -179.537 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -91.3 -43.02 10.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.032 -179.215 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.458 ' HB3' ' O ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -71.24 -16.73 62.51 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.675 0.25 . . . . 0.0 111.675 -178.949 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.442 ' HB2' ' C ' ' A' ' 13' ' ' ASP . 1.5 tt -80.29 -36.89 33.75 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.014 0.435 . . . . 0.0 110.014 179.3 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.717 HD13 ' HB3' ' A' ' 24' ' ' ASP . 0.4 OUTLIER -66.8 -42.65 85.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.785 179.707 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.9 mt -60.55 -41.0 93.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.888 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -57.82 -27.53 63.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.911 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.96 39.89 0.21 Allowed Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.537 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.426 ' CG ' HD22 ' A' ' 17' ' ' LEU . 76.4 t80 -119.75 154.09 34.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.815 0.34 . . . . 0.0 110.823 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.43 ' O ' HG12 ' A' ' 26' ' ' VAL . 5.6 t0 -68.29 132.27 46.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.922 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.717 ' HB3' HD13 ' A' ' 18' ' ' LEU . 5.5 p-10 -90.64 -26.28 19.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.024 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.8 m -68.52 -32.13 71.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.319 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.43 HG12 ' O ' ' A' ' 23' ' ' ASP . 14.1 p -67.85 -30.92 50.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.412 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.802 HD13 ' CE2' ' A' ' 14' ' ' PHE . 1.0 OUTLIER -63.88 -36.66 84.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.021 -179.839 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -64.38 -18.82 65.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.221 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -86.95 -36.71 18.16 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.094 -179.796 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.766 HG13 HD12 ' A' ' 31' ' ' ILE . 13.3 p -86.05 -47.8 16.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.369 -179.768 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.766 HD12 HG13 ' A' ' 30' ' ' VAL . 1.7 mp -59.58 -40.12 81.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.958 0.408 . . . . 0.0 110.105 179.542 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.833 HD23 ' N ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -52.21 -62.9 1.34 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.804 179.78 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.833 ' N ' HD23 ' A' ' 32' ' ' LEU . 99.3 m -51.59 -41.0 60.87 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.788 0.328 . . . . 0.0 111.139 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 78.9 mt -59.2 -36.22 74.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.71 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.414 ' HB3' ' NH1' ' A' ' 35' ' ' ARG . 3.0 mtm105 -104.18 19.99 19.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.239 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.452 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 1.4 mmpt? -108.58 15.5 23.72 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.547 0.213 . . . . 0.0 111.496 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.6 mtmt 59.43 21.52 9.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.68 0.276 . . . . 0.0 110.604 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -89.36 110.76 41.14 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.15 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.62 115.03 4.18 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.445 2.097 . . . . 0.0 112.276 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.501 HD13 ' SG ' ' A' ' 59' ' ' CYS . 3.4 mt -61.39 140.62 58.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.89 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -74.09 154.59 88.56 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.894 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.21 -12.49 35.78 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.618 2.212 . . . . 0.0 112.499 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -87.22 8.89 22.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.409 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -90.49 10.07 26.77 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.695 -0.229 . . . . 0.0 111.218 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 64.19 41.7 5.98 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.912 0.387 . . . . 0.0 110.971 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -87.88 79.71 8.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.903 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -139.66 -179.81 6.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.838 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -81.17 123.58 28.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.185 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.438 HD11 ' CG ' ' A' ' 58' ' ' GLU . 10.2 mt -72.21 -177.52 2.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.846 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.2 mttt -125.25 171.14 10.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.802 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.03 -131.27 11.64 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.467 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 19.8 mttt -63.74 -31.45 72.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.719 0.295 . . . . 0.0 110.868 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -97.5 38.97 1.22 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.96 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.439 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 19.4 mttt -73.28 -50.31 6.45 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.09 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.439 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 4.7 Cg_exo -79.81 44.84 1.8 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.883 2.389 . . . . 0.0 112.464 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.404 ' CG ' ' O ' ' A' ' 55' ' ' PRO . 82.6 m-85 -156.7 178.29 10.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.831 0.348 . . . . 0.0 110.953 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.521 ' O ' HG13 ' A' ' 68' ' ' VAL . 0.1 OUTLIER -132.85 131.37 40.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.841 179.968 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.438 ' CG ' HD11 ' A' ' 49' ' ' LEU . 1.8 tt0 -95.99 171.33 8.69 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.938 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.501 ' SG ' HD13 ' A' ' 40' ' ' LEU . 11.5 t -171.02 118.8 0.49 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.817 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.51 ' CD2' HD22 ' A' ' 66' ' ' LEU . 1.0 OUTLIER -93.3 99.98 12.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.937 -179.905 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.589 ' H ' HD12 ' A' ' 61' ' ' ILE . 4.8 mp -70.42 -53.65 21.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.904 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.445 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 0.1 OUTLIER -112.64 172.25 3.68 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.49 179.757 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.445 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 18.1 Cg_exo -65.99 -4.6 10.48 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.51 2.14 . . . . 0.0 112.931 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -143.59 28.46 1.46 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.029 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.736 HG11 HG21 ' A' ' 30' ' ' VAL . 58.4 t -140.46 143.46 29.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.334 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.758 HD12 HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -159.12 111.05 2.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.792 179.742 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.59 HD12 ' O ' ' A' ' 68' ' ' VAL . 0.1 OUTLIER -113.48 134.45 54.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.865 -179.885 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.59 ' O ' HD12 ' A' ' 67' ' ' LEU . 21.7 t -91.88 145.91 6.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.92 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 51.7 p90 -156.17 160.13 39.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.987 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.694 ' HB2' HD11 ' A' ' 77' ' ' ILE . 2.6 tp -109.32 161.24 15.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.824 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.9 t -120.92 100.62 9.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.084 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.56 166.32 23.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.817 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -40.45 -32.25 0.19 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.596 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -167.35 37.7 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.829 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -160.51 102.84 1.38 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.106 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.439 ' C ' HD23 ' A' ' 76' ' ' LEU . 10.5 tt -67.92 134.96 51.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.66 179.747 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.709 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.2 pp -126.37 128.65 71.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.333 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 82.5 mt -74.27 149.2 40.86 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.546 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -109.81 -71.03 0.78 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.261 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.59 159.21 36.84 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.163 0.506 . . . . 0.0 111.106 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.802 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.9 tm? -113.79 136.78 52.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.535 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.802 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -157.46 173.33 34.91 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.654 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.5 m -108.73 170.27 8.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.839 0.352 . . . . 0.0 110.868 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 4.0 t-80 -59.09 -26.72 64.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.059 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.7 t -83.79 -27.51 28.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.136 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -81.29 -69.74 0.59 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.022 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.758 HD12 HD12 ' A' ' 66' ' ' LEU . 35.1 mt -67.6 -37.87 83.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.002 -179.82 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.207 -0.901 . . . . 0.0 110.892 -179.982 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.685 HD12 ' HB2' ' A' ' 76' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.816 0.341 . . . . 0.0 110.922 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.52 146.62 39.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.979 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.418 HD11 HD11 ' A' ' 78' ' ' LEU . 7.3 tt -122.01 152.33 39.87 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.861 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.743 ' HB2' HG22 ' A' ' 77' ' ' ILE . 1.8 t30 -138.88 171.36 14.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.937 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.0 mp -147.12 116.69 7.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.919 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -79.82 171.14 15.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.851 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.3 ttpt -60.71 -31.24 70.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.942 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.1 m -72.99 -50.22 24.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.884 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -59.96 -35.7 75.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.812 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -63.41 -37.28 86.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.955 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.561 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 4.7 mmtt -89.16 -22.86 22.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.084 0.468 . . . . 0.0 111.097 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.442 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 4.9 m-20 -90.95 -11.11 40.01 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.232 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.637 ' O ' HD13 ' A' ' 18' ' ' LEU . 29.3 t80 -90.86 -67.38 0.85 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.833 0.349 . . . . 0.0 111.367 -179.558 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.821 ' HA ' HD22 ' A' ' 18' ' ' LEU . 49.6 m-20 -91.09 -33.26 15.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.193 -179.18 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.561 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 12.6 mmtt -76.69 -26.79 55.13 Favored 'General case' 0 C--N 1.334 -0.096 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.161 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.442 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 29.2 tp -71.8 -33.01 68.19 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.185 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.821 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.1 OUTLIER -57.16 -33.58 67.56 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.821 179.967 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.7 mt -89.91 -3.32 58.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.454 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -97.7 26.81 4.77 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.669 0.271 . . . . 0.0 110.995 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 93.26 23.07 25.5 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.786 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.498 ' CD1' HD12 ' A' ' 18' ' ' LEU . 13.0 t80 -110.26 144.19 39.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.834 0.349 . . . . 0.0 110.797 179.768 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.419 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 5.1 t0 -99.61 113.4 25.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.004 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -58.1 -21.03 44.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.424 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.4 m -50.28 -54.43 21.34 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.775 0.322 . . . . 0.0 111.206 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.4 t -68.6 -34.62 66.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.984 0.421 . . . . 0.0 111.156 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.566 HD22 HD11 ' A' ' 18' ' ' LEU . 6.8 tp -65.56 -33.57 76.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.702 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -56.54 -57.92 10.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.128 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.558 ' HA ' HD22 ' A' ' 32' ' ' LEU . 4.6 mt-10 -50.5 -25.78 4.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.466 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.658 HG13 HG21 ' A' ' 61' ' ' ILE . 58.0 t -80.98 -68.25 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.911 0.386 . . . . 0.0 111.573 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.532 HD13 ' CD1' ' A' ' 27' ' ' LEU . 1.1 mp -51.38 -46.33 34.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.842 -179.286 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.832 HD23 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -55.96 -24.6 39.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.645 0.26 . . . . 0.0 111.314 -179.579 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.832 ' N ' HD23 ' A' ' 32' ' ' LEU . 27.4 m -82.11 -30.43 31.17 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.053 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.78 HD21 HD21 ' A' ' 40' ' ' LEU . 3.0 mt -90.13 -28.57 18.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.459 -179.634 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.401 ' HB3' ' NH1' ' A' ' 35' ' ' ARG . 14.0 mtm105 -94.16 20.11 8.43 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.692 -179.535 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.466 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 4.2 mttt -118.19 -55.72 2.22 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.142 -0.223 . . . . 0.0 110.946 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.466 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 7.3 pttt 156.12 -20.53 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.965 179.521 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -59.44 111.47 3.84 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.955 -179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 158.73 56.03 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.368 2.046 . . . . 0.0 112.164 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.78 HD21 HD21 ' A' ' 34' ' ' LEU . 13.0 mt -82.64 116.03 21.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.905 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.405 ' HB2' ' CE2' ' A' ' 44' ' ' PHE . 83.3 m-20 -62.66 158.4 51.26 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.956 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.47 -11.33 30.97 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.626 2.217 . . . . 0.0 112.505 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.08 17.21 11.23 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.203 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.405 ' CE2' ' HB2' ' A' ' 41' ' ' ASP . 19.6 m-85 -98.04 6.67 47.36 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.261 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 44.5 mm-40 64.8 41.61 4.95 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.848 0.356 . . . . 0.0 110.889 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -86.62 90.4 8.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.933 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 70.2 m-70 -136.67 173.16 12.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.982 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.07 158.01 32.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.156 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.74 HD21 ' CD ' ' A' ' 58' ' ' GLU . 1.8 mp -112.07 -175.43 2.69 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.832 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.3 mttm -124.04 167.68 13.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.909 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 77.29 -133.27 13.02 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.497 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 10.8 mptt -60.45 -31.66 70.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.78 0.324 . . . . 0.0 110.854 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 17.1 m95 -98.63 38.69 1.33 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.973 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.5 -53.73 16.24 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.953 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.415 ' HG2' ' CE1' ' A' ' 56' ' ' PHE . 93.8 Cg_endo -84.94 34.62 0.51 Allowed 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.644 2.229 . . . . 0.0 112.609 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.463 ' HE2' HD21 ' A' ' 79' ' ' LEU . 81.3 m-85 -132.25 -175.45 3.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.878 0.371 . . . . 0.0 110.879 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.11 137.59 36.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.857 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.74 ' CD ' HD21 ' A' ' 49' ' ' LEU . 2.1 tt0 -98.66 171.33 8.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.819 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.476 ' SG ' HD13 ' A' ' 40' ' ' LEU . 9.7 t -167.08 111.88 0.74 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.875 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.63 ' CE1' HD22 ' A' ' 66' ' ' LEU . 10.6 m170 -90.5 82.78 5.84 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.898 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.658 HG21 HG13 ' A' ' 30' ' ' VAL . 3.5 mp -56.13 -31.72 32.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.85 0.357 . . . . 0.0 110.93 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.529 ' HB2' HG23 ' A' ' 65' ' ' VAL . 0.0 OUTLIER -130.59 170.38 11.28 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.653 179.932 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.42 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 11.5 Cg_exo -70.75 0.96 5.59 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.852 2.368 . . . . 0.0 112.952 -179.667 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -147.27 27.46 1.03 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.788 0.328 . . . . 0.0 110.831 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.832 ' O ' HD23 ' A' ' 66' ' ' LEU . 40.6 t -135.26 152.58 32.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.08 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.832 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.8 OUTLIER -146.98 104.2 3.67 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.693 179.771 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.632 ' HB3' HD11 ' A' ' 61' ' ' ILE . 4.2 tp -104.95 121.75 44.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.034 -179.66 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.626 ' N ' HD12 ' A' ' 67' ' ' LEU . 46.3 t -99.08 135.93 32.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.794 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.458 ' CD1' HD11 ' A' ' 76' ' ' LEU . 46.4 p90 -153.3 161.97 41.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.051 -179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.743 ' O ' HD12 ' A' ' 76' ' ' LEU . 5.4 tp -109.96 169.06 8.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.777 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.1 t -127.34 106.66 15.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.133 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.43 163.34 21.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.675 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -43.62 -40.82 4.29 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.467 -179.759 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -150.04 29.25 0.73 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.897 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -151.26 151.67 32.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.828 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.743 HD12 ' O ' ' A' ' 70' ' ' LEU . 37.5 tp -115.09 137.14 52.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.691 179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.743 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.0 pp -130.76 131.3 64.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.275 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.418 HD11 HD11 ' A' ' 4' ' ' LEU . 41.2 mt -82.66 136.9 34.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.788 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.463 HD21 ' HE2' ' A' ' 56' ' ' PHE . 0.3 OUTLIER -92.29 -71.29 0.65 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.982 -179.782 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.417 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -157.42 165.6 35.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.138 -179.957 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.578 ' C ' HD13 ' A' ' 81' ' ' LEU . 3.4 tm? -122.4 123.51 41.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.806 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -138.24 -169.59 11.63 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.416 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -140.29 -178.25 5.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.79 0.328 . . . . 0.0 110.865 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 5.6 t-80 -67.99 -28.71 67.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.032 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 17.9 m -89.95 -26.9 20.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.067 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.81 -68.6 0.68 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.048 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.658 HD12 ' HB2' ' A' ' 66' ' ' LEU . 16.6 mt -71.75 -38.6 70.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.068 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.903 -179.982 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.1 mt . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.869 0.366 . . . . 0.0 110.88 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.4 ' HB2' ' HG3' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -59.02 150.44 24.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.859 179.946 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.628 HD11 HD11 ' A' ' 78' ' ' LEU . 8.6 tt -116.09 144.84 43.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.086 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.84 ' HB2' HG22 ' A' ' 77' ' ' ILE . 0.1 OUTLIER -133.67 -173.03 3.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.804 179.884 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.569 ' H ' HD21 ' A' ' 5' ' ' ASN . 3.9 mp -143.91 140.77 29.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.96 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.8 165.58 11.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.819 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.84 -31.33 70.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.795 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.0 t -74.62 -47.8 30.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.941 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.43 ' CE2' HD13 ' A' ' 78' ' ' LEU . 30.5 t80 -59.53 -38.04 79.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.934 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -60.71 -35.11 75.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.931 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.569 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 7.3 mtmp? -85.94 -20.0 29.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.147 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -90.59 -11.51 39.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.282 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.683 ' O ' HD13 ' A' ' 18' ' ' LEU . 46.0 t80 -90.57 -66.97 0.88 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.225 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.82 ' HA ' HD22 ' A' ' 18' ' ' LEU . 7.8 m-20 -90.96 -32.17 16.06 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.084 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.569 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -77.34 -27.29 52.67 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.263 -179.106 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.453 ' O ' ' HB3' ' A' ' 22' ' ' PHE . 1.1 tt -73.42 -33.62 65.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.936 0.398 . . . . 0.0 109.974 179.447 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.82 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.2 OUTLIER -54.91 -42.58 72.36 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.111 -179.983 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 85.8 mt -82.88 -3.26 56.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.543 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.96 37.44 1.31 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.853 0.359 . . . . 0.0 110.983 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 82.86 25.65 48.67 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.387 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.471 ' CD1' HD12 ' A' ' 18' ' ' LEU . 8.9 t80 -116.35 132.18 56.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.755 0.312 . . . . 0.0 110.782 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.403 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 13.5 t0 -87.34 124.11 33.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.907 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.841 ' HA ' HD23 ' A' ' 27' ' ' LEU . 11.5 p-10 -55.96 -27.43 52.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.069 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 72.7 m -57.09 -22.77 42.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.174 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.433 ' HB ' ' CZ ' ' A' ' 22' ' ' PHE . 27.1 t -83.64 -45.65 18.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.312 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.841 HD23 ' HA ' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -59.09 -35.64 73.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.905 -179.798 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.29 -26.75 61.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.859 179.832 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -73.89 -45.36 51.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.881 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.582 HG23 ' CG1' ' A' ' 61' ' ' ILE . 9.2 p -78.74 -47.99 22.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.274 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.498 ' N ' HG13 ' A' ' 30' ' ' VAL . 1.4 mp -50.08 -35.95 11.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.928 0.394 . . . . 0.0 110.413 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.806 HD23 ' N ' ' A' ' 33' ' ' THR . 1.0 OUTLIER -52.76 -62.6 1.54 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.419 179.448 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.806 ' N ' HD23 ' A' ' 32' ' ' LEU . 72.3 m -51.41 -25.74 6.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.552 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 18.8 mt -73.58 -66.54 0.68 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.789 0.328 . . . . 0.0 110.933 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.6 mtt180 -60.21 -52.0 67.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.78 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.704 ' HE2' HD21 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -68.16 -14.31 62.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.405 179.849 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.528 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 3.0 ptmt 51.96 69.17 0.7 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.583 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.738 ' HB3' HG23 ' A' ' 33' ' ' THR . 7.2 tt0 -79.18 136.17 57.42 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.601 179.413 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.93 104.81 0.2 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.423 2.082 . . . . 0.0 112.104 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 64.0 mt -67.47 127.76 33.89 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.009 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -80.89 157.93 71.01 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.841 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -64.49 -26.97 62.24 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 122.505 2.137 . . . . 0.0 112.239 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -62.24 -23.71 66.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.033 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -62.52 -18.48 62.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.172 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 63.82 41.76 6.59 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.822 0.344 . . . . 0.0 110.983 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -77.39 87.32 3.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.766 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -134.65 -177.67 4.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.934 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -90.43 124.2 34.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.209 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.714 HD11 ' CD ' ' A' ' 58' ' ' GLU . 15.6 mt -68.47 -177.38 0.92 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.796 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.0 mmtp -125.12 156.98 37.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.917 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 78.88 -116.85 4.43 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.552 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.9 tppt? -61.18 -30.23 70.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.742 0.306 . . . . 0.0 111.098 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.433 ' CE3' HD13 ' A' ' 49' ' ' LEU . 5.5 m-90 -114.41 47.88 1.18 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.937 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 1.4 tttt -79.59 -50.99 1.23 Allowed Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.256 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 83.4 Cg_endo -82.35 11.21 3.25 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.534 2.156 . . . . 0.0 112.853 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.497 ' CD1' HD21 ' A' ' 79' ' ' LEU . 95.6 m-85 -118.49 174.65 6.13 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.759 0.314 . . . . 0.0 110.972 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -125.42 127.15 46.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.952 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.714 ' CD ' HD11 ' A' ' 49' ' ' LEU . 2.7 tt0 -95.98 156.38 16.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.742 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 16.5 t -160.02 131.97 6.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.785 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.4 m170 -111.04 90.83 3.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.964 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.582 ' CG1' HG23 ' A' ' 30' ' ' VAL . 4.0 mp -55.4 -24.64 16.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.716 179.657 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.444 ' HB2' ' CD ' ' A' ' 63' ' ' PRO . 1.6 ptmt -155.15 169.82 9.67 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.392 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.444 ' CD ' ' HB2' ' A' ' 62' ' ' LYS . 16.3 Cg_exo -68.26 3.79 1.92 Allowed 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.688 2.259 . . . . 0.0 113.325 -179.463 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -138.31 30.38 2.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.703 0.287 . . . . 0.0 111.225 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.794 ' O ' HD23 ' A' ' 66' ' ' LEU . 79.3 t -155.38 153.56 7.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.91 0.386 . . . . 0.0 111.244 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.794 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.2 OUTLIER -150.34 86.91 1.42 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.481 179.657 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.461 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 4.3 tp -85.47 109.05 18.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.948 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.54 ' CG1' HD22 ' A' ' 79' ' ' LEU . 57.4 t -84.61 135.26 25.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.669 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -143.25 155.03 44.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.97 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.719 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.5 OUTLIER -106.29 147.3 29.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.891 -179.879 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.747 ' HA ' HD12 ' A' ' 76' ' ' LEU . 26.4 t -101.54 116.69 45.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.155 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.62 162.76 14.04 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.791 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -44.19 -48.89 9.3 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.594 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -139.24 29.66 2.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.971 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.4 ' HG3' ' HB2' ' A' ' 3' ' ' LYS . 15.6 mp0 -160.35 171.41 19.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.72 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.747 HD12 ' HA ' ' A' ' 71' ' ' VAL . 7.6 tp -130.9 148.59 52.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.785 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.84 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.1 pp -135.27 137.89 49.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.33 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.628 HD11 HD11 ' A' ' 4' ' ' LEU . 76.0 mt -81.68 133.58 35.37 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.651 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.54 HD22 ' CG1' ' A' ' 68' ' ' VAL . 0.3 OUTLIER -88.93 -70.42 0.65 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.972 -179.753 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.471 ' HD2' HD21 ' A' ' 87' ' ' LEU . 0.1 OUTLIER -158.1 179.44 9.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.223 -179.901 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.587 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.1 tm? -132.93 128.22 36.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.742 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.587 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -166.83 168.63 40.35 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.591 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.46 ' C ' HD11 ' A' ' 66' ' ' LEU . 87.9 p -109.82 177.5 4.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.869 0.366 . . . . 0.0 110.71 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.496 ' N ' HD11 ' A' ' 66' ' ' LEU . 14.7 t-80 -60.72 -26.69 67.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.007 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.44 -28.76 52.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.042 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -89.77 -71.82 0.59 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.022 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.471 HD21 ' HD2' ' A' ' 80' ' ' ARG . 29.0 mt -58.44 -42.94 88.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.04 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.833 179.971 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.4 mt . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.809 0.338 . . . . 0.0 110.963 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -104.28 151.51 23.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.894 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.608 HD21 HD11 ' A' ' 78' ' ' LEU . 5.7 tp -117.89 143.36 46.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.869 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.748 ' HB2' HG22 ' A' ' 77' ' ' ILE . 2.3 t30 -130.06 171.69 12.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.878 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.2 mp -135.51 115.35 13.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.838 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.2 mmtm -82.9 169.59 15.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.772 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.0 tttt -59.94 -31.06 69.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.891 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.1 m -73.37 -46.4 49.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.888 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -61.02 -29.95 70.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.896 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -59.22 -53.72 55.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.939 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.483 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 0.6 OUTLIER -78.33 -16.69 57.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.02 0.438 . . . . 0.0 111.31 -179.961 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.44 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 8.4 m-20 -90.52 -17.71 26.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.886 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.56 ' O ' HD13 ' A' ' 18' ' ' LEU . 76.9 t80 -90.94 -68.34 0.8 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.335 -179.627 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.803 ' HA ' HD22 ' A' ' 18' ' ' LEU . 15.3 m-20 -90.82 -41.57 11.14 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -178.922 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.483 ' HB3' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -69.96 -23.92 63.25 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.205 -179.014 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.44 ' HB2' ' HA ' ' A' ' 13' ' ' ASP . 25.7 tp -73.07 -35.6 66.69 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.803 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.1 OUTLIER -58.08 -43.44 87.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.854 179.855 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 20.2 mt -79.81 -4.69 53.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.393 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.69 22.85 7.59 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.759 0.314 . . . . 0.0 111.153 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 96.78 23.04 16.48 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.823 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.499 ' CD1' HD12 ' A' ' 18' ' ' LEU . 11.1 t80 -114.19 137.45 51.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.813 0.34 . . . . 0.0 110.839 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.424 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 1.9 t0 -92.68 119.65 32.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.033 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -59.17 -19.01 41.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.473 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.4 p -46.82 -49.08 20.59 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 120.698 0.285 . . . . 0.0 111.309 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.459 HG13 ' HD2' ' A' ' 62' ' ' LYS . 21.7 t -74.53 -34.61 35.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.985 0.422 . . . . 0.0 111.111 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.68 ' CD1' HD13 ' A' ' 31' ' ' ILE . 5.6 tp -64.72 -39.01 92.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.722 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -54.85 -41.94 71.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.18 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.546 ' C ' HD22 ' A' ' 32' ' ' LEU . 3.5 mt-10 -69.8 -12.22 61.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.393 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.424 HG13 HD13 ' A' ' 61' ' ' ILE . 77.7 t -90.43 -70.94 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.847 0.356 . . . . 0.0 111.693 -179.701 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.68 HD13 ' CD1' ' A' ' 27' ' ' LEU . 1.4 mp -49.46 -40.0 14.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.036 -179.067 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.764 HD23 ' N ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -62.4 -14.63 42.47 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.369 -179.669 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.764 ' N ' HD23 ' A' ' 32' ' ' LEU . 92.9 m -90.08 -30.11 17.91 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.744 0.307 . . . . 0.0 110.866 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.9 mt -88.64 -31.63 18.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.398 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 31.8 mtm180 -93.21 20.21 7.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.338 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.464 ' O ' ' CG ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -123.47 24.46 8.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.831 0.348 . . . . 0.0 111.341 -179.821 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.464 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 3.9 pttp 46.71 47.21 15.01 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.319 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -123.82 109.89 29.9 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.786 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -66.35 135.75 40.88 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.396 2.064 . . . . 0.0 112.238 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.43 HD13 ' SG ' ' A' ' 59' ' ' CYS . 1.7 mt -64.03 -178.99 0.37 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.847 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.07 160.49 38.87 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.909 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.53 -18.34 48.85 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.601 2.201 . . . . 0.0 112.438 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.59 -1.64 38.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.523 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.445 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.3 m-85 -78.41 -3.01 41.12 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.61 0.243 . . . . 0.0 111.401 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 62.39 43.62 7.96 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.883 0.373 . . . . 0.0 110.866 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -88.43 100.46 13.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.907 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 75.7 m80 -133.22 173.37 11.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.95 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -81.09 131.86 35.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.072 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.763 HD11 ' HG3' ' A' ' 58' ' ' GLU . 7.1 mt -81.21 -178.78 7.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.875 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.21 157.09 41.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.879 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.42 ' C ' ' H ' ' A' ' 53' ' ' TRP . . . 60.31 109.93 0.01 OUTLIER Glycine 0 CA--C 1.508 -0.402 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.516 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 70.22 -44.87 0.58 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.667 0.27 . . . . 0.0 110.966 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.42 ' H ' ' C ' ' A' ' 51' ' ' GLY . 8.3 m95 -105.09 35.7 2.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.881 0.372 . . . . 0.0 110.887 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.456 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.1 OUTLIER -68.21 -52.82 20.86 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.141 179.975 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.456 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 71.6 Cg_endo -77.79 4.51 6.01 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.435 2.09 . . . . 0.0 112.699 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.782 ' CD2' HD13 ' A' ' 70' ' ' LEU . 30.6 m-85 -104.0 172.62 6.7 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.832 0.348 . . . . 0.0 110.806 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 57.1 ttm-85 -133.03 137.6 46.51 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.918 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.763 ' HG3' HD11 ' A' ' 49' ' ' LEU . 0.8 OUTLIER -98.96 172.32 7.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.863 -179.959 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.43 ' SG ' HD13 ' A' ' 40' ' ' LEU . 17.7 t -166.13 129.47 2.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.76 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.47 ' CE1' HD22 ' A' ' 66' ' ' LEU . 2.5 m-70 -99.52 84.38 2.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.067 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.672 HD11 ' HB3' ' A' ' 67' ' ' LEU . 2.9 mp -58.17 -28.32 34.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.031 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.459 ' HD2' HG13 ' A' ' 26' ' ' VAL . 14.7 mttt -137.34 168.26 17.32 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.658 -179.86 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.404 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 42.5 Cg_endo -67.61 -3.19 9.77 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.397 2.065 . . . . 0.0 112.824 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -145.04 28.6 1.23 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.656 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.901 ' O ' HD23 ' A' ' 66' ' ' LEU . 51.8 t -137.73 145.79 28.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.282 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.901 HD23 ' O ' ' A' ' 65' ' ' VAL . 6.7 mt -140.32 119.78 13.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.547 179.392 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.697 HD12 ' N ' ' A' ' 68' ' ' VAL . 4.8 tp -116.16 127.88 55.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.227 -179.489 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.697 ' N ' HD12 ' A' ' 67' ' ' LEU . 46.0 t -103.97 138.09 29.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.479 179.489 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.45 ' CD1' HD11 ' A' ' 76' ' ' LEU . 46.0 p90 -151.78 164.77 36.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.914 0.387 . . . . 0.0 110.993 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.782 HD13 ' CD2' ' A' ' 56' ' ' PHE . 4.3 tp -114.37 179.69 3.88 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.851 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.6 t -122.07 111.47 30.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.03 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.32 168.29 9.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.962 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -62.05 106.47 0.72 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.846 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.3 t0 58.4 21.6 8.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.103 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -156.6 147.79 22.19 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.85 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.45 HD11 ' CD1' ' A' ' 69' ' ' TYR . 7.2 tt -111.97 147.88 34.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.873 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.77 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.1 pp -130.76 135.66 59.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.227 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.608 HD11 HD21 ' A' ' 4' ' ' LEU . 89.4 mt -84.0 148.67 26.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.707 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.419 ' HG ' ' CD2' ' A' ' 56' ' ' PHE . 0.7 OUTLIER -103.45 -68.38 0.84 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.968 -179.89 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.65 171.09 19.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.073 0.464 . . . . 0.0 111.303 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.688 HD13 ' N ' ' A' ' 82' ' ' GLY . 1.2 tm? -124.57 131.92 53.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.683 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.688 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -150.6 -161.91 10.27 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.712 -179.853 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -139.39 168.84 18.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.81 0.338 . . . . 0.0 110.824 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.414 ' HA ' HD11 ' A' ' 66' ' ' LEU . 2.3 t-160 -59.23 -27.78 66.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.12 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.4 m -89.99 -18.62 25.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.302 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -84.66 -67.62 0.78 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.789 0.328 . . . . 0.0 111.233 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.589 HD13 HD12 ' A' ' 66' ' ' LEU . 7.0 mp -52.52 -32.1 38.8 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.327 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.885 -179.999 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.1 mp . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.904 0.383 . . . . 0.0 111.051 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.36 163.06 3.24 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.651 179.676 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.781 HD13 ' HA ' ' A' ' 35' ' ' ARG . 1.3 tt -125.65 145.27 50.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.889 0.376 . . . . 0.0 110.985 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.462 ' HB2' HG22 ' A' ' 77' ' ' ILE . 5.5 t-20 -134.15 -176.64 4.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.988 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.7 mt -145.76 136.14 24.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.907 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -104.89 171.41 7.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.816 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.43 -34.07 72.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.937 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.9 m -66.04 -31.55 72.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.915 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.8 t80 -77.26 -32.75 55.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.915 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 87.8 mm-40 -69.94 -28.98 66.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.155 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.5 pttt -90.15 -53.26 4.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.241 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -53.61 -25.51 17.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.032 0.444 . . . . 0.0 111.133 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.895 ' O ' HD13 ' A' ' 18' ' ' LEU . 51.6 t80 -64.14 -71.21 0.18 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.724 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.411 ' HA ' ' HB2' ' A' ' 18' ' ' LEU . 1.0 OUTLIER -68.0 -26.21 65.79 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.427 179.121 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.3 ttmm -69.97 -31.02 68.52 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.675 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.475 ' O ' ' HB3' ' A' ' 22' ' ' PHE . 33.2 tp -90.28 -40.32 12.22 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 179.089 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.895 HD13 ' O ' ' A' ' 14' ' ' PHE . 4.7 mp -53.45 -36.27 61.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.01 179.759 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.528 ' C ' HD12 ' A' ' 19' ' ' LEU . 4.5 pp -90.08 -9.89 46.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.525 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -93.48 37.17 1.06 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.656 0.265 . . . . 0.0 111.204 -179.713 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.81 23.03 40.24 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.843 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.577 ' CZ ' HG13 ' A' ' 26' ' ' VAL . 34.7 t80 -116.77 112.11 20.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.838 0.352 . . . . 0.0 110.783 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.466 ' O ' HG12 ' A' ' 26' ' ' VAL . 3.7 t0 -57.52 146.46 29.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.083 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.654 ' HA ' HD23 ' A' ' 27' ' ' LEU . 20.3 p-10 -86.31 -11.31 52.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.18 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.9 t -78.62 -27.27 45.45 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.7 0.286 . . . . 0.0 110.998 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.577 HG13 ' CZ ' ' A' ' 22' ' ' PHE . 10.0 p -80.02 -27.43 12.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.326 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.654 HD23 ' HA ' ' A' ' 24' ' ' ASP . 1.5 pp -59.13 -38.57 79.97 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.107 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 15.8 t30 -59.23 -23.9 62.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.176 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -80.05 -45.32 18.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.145 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.779 ' CG2' HD13 ' A' ' 61' ' ' ILE . 12.4 p -77.69 -48.39 24.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.45 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.838 ' HA ' HD12 ' A' ' 34' ' ' LEU . 1.2 mp -57.05 -29.72 32.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.901 0.381 . . . . 0.0 110.43 179.584 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.807 HD23 ' N ' ' A' ' 33' ' ' THR . 0.2 OUTLIER -61.36 -65.85 0.63 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.273 179.382 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.807 ' N ' HD23 ' A' ' 32' ' ' LEU . 85.4 m -46.23 -24.26 0.44 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.937 -179.72 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.838 HD12 ' HA ' ' A' ' 31' ' ' ILE . 3.3 mt -89.29 -49.79 6.51 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.781 ' HA ' HD13 ' A' ' 4' ' ' LEU . 35.3 mtt180 -83.26 -16.82 44.85 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -178.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.535 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -94.38 18.88 10.36 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.624 0.249 . . . . 0.0 111.45 -179.619 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.434 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 1.3 ptpp? 45.49 48.37 10.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.33 179.921 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.595 ' HB3' HG23 ' A' ' 33' ' ' THR . 2.8 tp10 -90.63 136.97 27.41 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.783 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -68.07 137.08 39.83 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.453 2.102 . . . . 0.0 112.288 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.635 HD22 ' SG ' ' A' ' 59' ' ' CYS . 2.6 mt -96.15 148.33 22.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.911 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.37 164.07 21.19 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.92 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.41 -29.66 45.24 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.578 2.185 . . . . 0.0 112.252 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -19.67 65.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.101 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.424 ' CE2' ' HA ' ' A' ' 61' ' ' ILE . 4.8 m-85 -62.64 -17.87 61.22 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.234 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 73.8 mm-40 66.73 38.72 3.8 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.874 0.368 . . . . 0.0 110.881 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -76.75 122.11 24.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.893 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -168.0 -178.08 3.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.877 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.19 134.76 36.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.027 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.2 mt -70.11 -176.64 1.19 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.928 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.78 -178.32 3.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.967 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 65.81 -140.47 40.4 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.528 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.0 -7.65 54.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.532 0.206 . . . . 0.0 111.369 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 5.0 m95 -96.17 37.6 1.24 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.88 0.372 . . . . 0.0 110.832 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.503 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -69.88 -50.24 17.82 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.407 179.997 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 64.0 Cg_endo -74.58 51.62 2.67 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.175 1.916 . . . . 0.0 112.66 -179.811 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.655 ' HD1' HD13 ' A' ' 70' ' ' LEU . 63.8 m-85 -152.99 175.59 12.79 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.761 179.585 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.24 144.62 44.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.922 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.502 ' OE2' HD22 ' A' ' 87' ' ' LEU . 2.1 tt0 -113.26 171.63 7.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.749 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.635 ' SG ' HD22 ' A' ' 40' ' ' LEU . 8.2 t -168.34 110.75 0.57 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.925 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.593 ' CD2' HD22 ' A' ' 66' ' ' LEU . 10.8 m170 -84.9 83.62 7.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.94 179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.779 HD13 ' CG2' ' A' ' 30' ' ' VAL . 4.0 mp -53.63 -27.59 15.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.037 179.723 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.487 ' NZ ' HG22 ' A' ' 26' ' ' VAL . 0.0 OUTLIER -159.49 169.74 9.93 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.382 179.714 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.434 ' CD ' ' HB2' ' A' ' 62' ' ' LYS . 15.3 Cg_exo -68.77 5.52 1.31 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.705 2.27 . . . . 0.0 113.29 -179.467 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -138.9 24.69 2.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.56 0.219 . . . . 0.0 111.39 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.871 ' O ' HD23 ' A' ' 66' ' ' LEU . 42.0 t -155.35 145.68 12.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 121.036 0.446 . . . . 0.0 111.603 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.871 HD23 ' O ' ' A' ' 65' ' ' VAL . 15.7 mt -141.68 107.52 5.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.428 179.506 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.641 ' C ' HD13 ' A' ' 67' ' ' LEU . 2.5 tm? -99.84 134.05 43.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.933 0.397 . . . . 0.0 111.365 -179.608 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.524 ' H ' HD22 ' A' ' 67' ' ' LEU . 98.6 t -113.12 119.93 61.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.879 178.657 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.56 ' HB3' HD11 ' A' ' 67' ' ' LEU . 20.3 p90 -132.97 155.7 48.65 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.953 0.406 . . . . 0.0 111.323 -179.001 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.807 ' HB2' HD11 ' A' ' 77' ' ' ILE . 6.6 tp -109.54 171.09 7.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.852 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 20.2 t -122.93 104.98 15.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.262 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.0 164.41 24.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.776 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -41.94 -36.19 1.03 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.55 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -157.48 27.63 0.29 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.864 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -151.36 162.75 40.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.816 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.441 HD11 ' CD2' ' A' ' 69' ' ' TYR . 6.5 tp -114.03 147.6 38.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.583 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.807 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.2 pp -136.4 126.55 40.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.373 -179.709 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 78.5 mt -80.32 115.68 19.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.55 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.554 HD23 ' NH1' ' A' ' 80' ' ' ARG . 0.5 OUTLIER -72.5 -66.58 0.64 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.09 -179.82 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.599 ' O ' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -163.77 176.06 9.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.049 0.452 . . . . 0.0 111.331 179.802 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.767 HD11 HG13 ' A' ' 65' ' ' VAL . 1.4 tm? -131.86 117.44 18.51 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.714 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.483 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -120.71 -161.15 11.34 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.58 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.8 m -134.19 153.01 52.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.069 0.461 . . . . 0.0 110.912 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.848 ' HA ' HD11 ' A' ' 66' ' ' LEU . 0.6 OUTLIER -49.42 -28.48 5.23 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.344 -179.795 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 12.7 t -90.19 -20.67 22.77 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.239 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.5 -71.22 0.47 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.152 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.703 HD13 HD12 ' A' ' 66' ' ' LEU . 4.3 mp -49.93 -27.46 5.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.372 -179.661 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.215 -0.897 . . . . 0.0 110.916 179.982 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 7.1 mt . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.789 0.328 . . . . 0.0 111.008 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.85 146.94 40.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.874 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.405 HD21 HH21 ' A' ' 35' ' ' ARG . 0.6 OUTLIER -118.2 148.3 42.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.912 179.87 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.775 ' HB2' HG22 ' A' ' 77' ' ' ILE . 4.6 t30 -133.56 171.14 14.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.917 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.1 mt -137.97 104.13 5.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.9 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -78.41 165.94 23.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.816 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -60.39 -38.85 85.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.812 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.8 t -68.85 -31.45 70.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.924 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.474 ' CZ ' HD13 ' A' ' 78' ' ' LEU . 56.0 t80 -80.92 -37.34 29.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.936 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -57.22 -36.33 70.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.974 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.472 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 4.7 mtpm? -90.06 -17.87 26.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.14 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.452 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 3.9 m-20 -90.53 -17.26 27.34 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.276 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.568 ' O ' HD13 ' A' ' 18' ' ' LEU . 65.9 t80 -91.1 -68.43 0.79 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.425 -179.658 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.796 ' HA ' HD22 ' A' ' 18' ' ' LEU . 1.3 t0 -90.95 -40.9 11.43 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.472 ' HB3' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -70.36 -26.46 63.74 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.677 -0.409 . . . . 0.0 111.086 -179.117 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.452 ' HB2' ' HA ' ' A' ' 13' ' ' ASP . 20.5 tp -69.8 -33.32 72.2 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 179.012 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.796 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.1 OUTLIER -61.36 -30.77 70.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.802 179.904 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 21.6 mt -86.36 -32.8 20.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.066 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -60.89 -19.48 60.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.075 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 133.04 34.04 0.35 Allowed Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.574 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.482 ' HB3' ' HA ' ' A' ' 18' ' ' LEU . 12.1 t80 -113.2 146.51 39.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.737 0.303 . . . . 0.0 110.726 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.432 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 43.0 t0 -95.08 106.79 18.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.012 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -51.91 -24.99 7.13 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.317 -179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -50.68 -44.06 57.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.788 0.328 . . . . 0.0 111.158 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.6 t -77.28 -35.82 23.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.003 0.43 . . . . 0.0 111.059 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.662 HD11 HD13 ' A' ' 31' ' ' ILE . 3.9 tp -59.79 -40.31 87.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.641 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.439 ' O ' HD22 ' A' ' 32' ' ' LEU . 34.0 t30 -55.94 -42.45 76.19 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.053 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.53 ' C ' HD22 ' A' ' 32' ' ' LEU . 5.9 mm-40 -61.77 -16.62 51.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.4 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.479 ' CG1' HD13 ' A' ' 61' ' ' ILE . 60.8 t -90.33 -70.4 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.814 0.34 . . . . 0.0 111.807 -179.579 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.662 HD13 HD11 ' A' ' 27' ' ' LEU . 1.2 mp -50.66 -36.47 14.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.121 -0.49 . . . . 0.0 112.219 -178.898 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.721 HD23 ' N ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -67.24 -11.19 56.8 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 120.909 -0.316 . . . . 0.0 111.352 -179.869 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.721 ' N ' HD23 ' A' ' 32' ' ' LEU . 86.3 m -90.57 -35.84 14.8 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.925 0.393 . . . . 0.0 111.048 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.432 ' CD2' HD21 ' A' ' 40' ' ' LEU . 8.7 mt -90.06 -65.04 1.05 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.912 -179.137 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.442 ' HD2' HG23 ' A' ' 31' ' ' ILE . 12.2 mtt180 -49.54 -21.99 1.13 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.106 -179.129 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.544 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -90.49 21.25 4.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.638 0.256 . . . . 0.0 111.526 -179.882 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.438 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 0.2 OUTLIER 46.1 61.66 2.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.007 0.432 . . . . 0.0 111.513 -179.935 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -119.58 144.07 36.07 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.746 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.0 141.56 40.46 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.423 2.082 . . . . 0.0 112.379 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.716 HD22 ' CE2' ' A' ' 44' ' ' PHE . 54.0 mt -84.73 141.07 30.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.925 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.29 159.47 77.67 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.874 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -61.55 -27.03 81.38 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.603 2.202 . . . . 0.0 112.241 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -64.21 -26.54 68.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.971 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.716 ' CE2' HD22 ' A' ' 40' ' ' LEU . 3.1 m-30 -58.25 -53.53 57.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.76 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 60.91 83.53 0.14 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.959 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -92.53 105.35 17.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.878 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -130.69 -177.2 4.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.914 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -95.07 136.65 35.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.087 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.807 HD13 ' HB3' ' A' ' 53' ' ' TRP . 1.5 mp -70.11 -168.38 0.21 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.84 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.3 mmtt -137.8 150.34 47.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.791 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 60.39 110.52 0.01 OUTLIER Glycine 0 CA--C 1.507 -0.413 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.655 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.7 tptm 70.15 -45.67 0.59 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.713 0.292 . . . . 0.0 110.953 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.807 ' HB3' HD13 ' A' ' 49' ' ' LEU . 90.9 m95 -98.95 33.25 2.4 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.964 0.412 . . . . 0.0 110.822 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.484 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 1.3 tttm -70.1 -49.41 18.6 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.673 -179.865 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.484 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 72.9 Cg_endo -77.31 5.85 4.79 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.419 2.079 . . . . 0.0 113.191 -179.481 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -110.06 173.36 6.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.824 0.345 . . . . 0.0 110.959 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.755 ' O ' HG13 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -129.04 144.53 51.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.956 -179.858 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.657 ' HG3' HG22 ' A' ' 68' ' ' VAL . 4.1 tt0 -106.45 179.36 4.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.888 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.6 t -170.96 120.99 0.54 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.834 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -99.2 78.66 2.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.976 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.538 HD11 ' HB3' ' A' ' 67' ' ' LEU . 2.9 mp -59.6 -29.14 41.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.113 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.475 ' HB2' HG23 ' A' ' 65' ' ' VAL . 14.1 mtpt -135.84 168.73 16.02 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.85 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.405 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 12.1 Cg_exo -70.03 -1.08 8.1 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.871 2.38 . . . . 0.0 112.931 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 -143.06 26.66 1.66 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.704 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.79 ' O ' HD23 ' A' ' 66' ' ' LEU . 42.8 t -137.26 150.93 26.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.107 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.868 HD12 HD12 ' A' ' 87' ' ' LEU . 1.1 mt -147.91 87.5 1.62 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.614 179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.74 HD12 ' N ' ' A' ' 68' ' ' VAL . 6.4 tp -82.94 134.31 35.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.115 -179.615 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.755 HG13 ' O ' ' A' ' 57' ' ' ARG . 38.8 t -113.38 140.29 34.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.665 179.69 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 52.1 p90 -155.49 162.86 40.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.111 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.69 ' HB2' HD11 ' A' ' 77' ' ' ILE . 2.2 tp -112.35 173.08 6.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.833 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -127.42 102.33 8.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.205 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.34 164.57 26.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.798 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -43.44 -43.91 5.54 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.58 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -145.12 26.39 1.34 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.994 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -150.46 167.36 27.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.798 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.1 tt -126.15 134.81 51.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.727 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.775 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.4 pp -125.73 132.53 70.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.446 -179.763 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.474 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 92.5 mt -77.8 139.28 39.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.605 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -94.0 -64.56 1.07 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.013 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.484 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.2 OUTLIER -168.75 171.47 8.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.988 0.423 . . . . 0.0 111.206 -179.949 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.508 ' C ' HD13 ' A' ' 81' ' ' LEU . 2.7 tm? -128.54 121.61 29.18 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.696 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.479 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -137.42 -165.97 10.59 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.642 -0.789 . . . . 0.0 112.575 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.4 m -152.43 -171.55 3.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.904 0.383 . . . . 0.0 110.822 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 -73.39 -28.45 62.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.044 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.47 -23.21 22.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.13 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -89.89 -68.75 0.76 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.984 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.868 HD12 HD12 ' A' ' 66' ' ' LEU . 72.8 mt -59.1 -42.84 91.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.94 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.226 -0.892 . . . . 0.0 110.911 -179.959 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 21.0 mt . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.838 0.352 . . . . 0.0 110.961 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.86 150.98 26.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.866 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.5 tt -122.08 144.89 48.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.977 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.656 ' HB2' HG22 ' A' ' 77' ' ' ILE . 5.9 t30 -130.56 179.18 6.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.955 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -140.64 121.87 14.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.911 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -92.87 168.85 10.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.929 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -65.53 -41.17 93.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.836 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.72 -32.83 74.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.856 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.562 ' HE1' HD13 ' A' ' 67' ' ' LEU . 51.8 t80 -69.72 -30.87 68.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.873 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -63.88 -50.82 67.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.946 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.564 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 46.6 mttp -76.5 -14.16 60.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.993 0.425 . . . . 0.0 111.264 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.447 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 3.8 m-20 -90.42 -11.78 39.42 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.798 179.551 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.865 ' O ' HD13 ' A' ' 18' ' ' LEU . 37.1 t80 -90.77 -74.97 0.48 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.138 -179.687 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -90.39 -31.79 16.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.842 -179.189 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.564 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -77.03 -13.1 60.0 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.626 -0.429 . . . . 0.0 110.816 -179.948 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.474 HD12 ' HB3' ' A' ' 20' ' ' ASN . 27.2 tp -86.98 -30.99 20.84 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 178.8 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.865 HD13 ' O ' ' A' ' 14' ' ' PHE . 4.2 mp -45.57 -51.27 12.22 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.309 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.5 pp -72.42 -6.44 43.55 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.001 -179.305 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.474 ' HB3' HD12 ' A' ' 17' ' ' LEU . 18.7 t-20 -93.29 37.63 1.04 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.745 0.307 . . . . 0.0 111.051 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.73 23.11 70.6 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.24 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.685 ' CD1' HD12 ' A' ' 18' ' ' LEU . 51.7 t80 -109.78 124.78 51.88 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.833 0.349 . . . . 0.0 110.832 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.504 ' HB3' HG12 ' A' ' 26' ' ' VAL . 18.0 t0 -64.67 141.36 58.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.927 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.894 ' HA ' HD23 ' A' ' 27' ' ' LEU . 2.4 p30 -94.0 -20.62 19.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.352 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.6 m -76.64 -26.43 54.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.831 0.348 . . . . 0.0 111.286 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.504 HG12 ' HB3' ' A' ' 23' ' ' ASP . 13.7 p -78.76 -33.29 16.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.373 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.894 HD23 ' HA ' ' A' ' 24' ' ' ASP . 1.3 pp -62.04 -36.95 83.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.043 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.56 ' O ' HD22 ' A' ' 32' ' ' LEU . 43.2 t-20 -58.89 -24.81 62.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.046 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.407 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 9.8 mt-10 -75.62 -33.95 60.54 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.1 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.697 HG13 HD12 ' A' ' 31' ' ' ILE . 11.4 p -90.7 -34.52 6.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.557 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.697 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -70.56 -48.05 61.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.749 -179.339 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.747 HD23 ' N ' ' A' ' 33' ' ' THR . 0.5 OUTLIER -60.19 -16.08 29.98 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.523 0.194 . . . . 0.0 111.523 -179.395 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.747 ' N ' HD23 ' A' ' 32' ' ' LEU . 88.6 m -90.18 -26.63 20.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.659 0.266 . . . . 0.0 111.115 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.5 mt -87.32 -46.72 9.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.398 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 68.8 mtp180 -74.22 -5.49 42.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.794 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.497 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -97.97 25.29 6.14 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.757 0.313 . . . . 0.0 111.438 -179.661 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.471 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 53.6 pttt 46.53 29.96 1.01 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.24 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -90.25 130.55 41.56 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.791 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -75.89 148.94 32.56 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.442 2.095 . . . . 0.0 112.422 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.489 HD13 ' SG ' ' A' ' 59' ' ' CYS . 16.0 mt -90.59 142.24 27.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.888 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.429 ' HB2' ' CE1' ' A' ' 44' ' ' PHE . 1.6 m-20 -73.71 157.25 87.72 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.03 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.6 -9.76 26.47 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.604 2.203 . . . . 0.0 112.557 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -96.23 30.97 2.31 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.766 0.317 . . . . 0.0 110.94 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.439 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.3 m-30 -100.42 -11.17 20.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.305 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 65.95 44.92 2.6 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.851 0.358 . . . . 0.0 110.925 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.9 p-10 -89.15 76.93 7.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.888 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -119.82 176.79 5.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.915 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.91 136.25 38.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.064 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.561 ' H ' HD12 ' A' ' 49' ' ' LEU . 2.5 mp -78.13 -172.69 2.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.914 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.0 mmtm -130.41 171.39 13.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.95 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.19 -128.17 11.47 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.5 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.7 mmtp -69.98 -23.25 63.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.705 0.288 . . . . 0.0 110.978 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 18.9 m-90 -96.68 31.82 2.22 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.889 0.376 . . . . 0.0 110.998 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.446 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.2 OUTLIER -66.12 -51.45 45.3 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.064 179.905 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 98.7 Cg_endo -80.09 46.56 2.27 Favored 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.422 2.081 . . . . 0.0 112.487 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -154.96 179.11 9.44 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.918 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 -139.69 138.98 36.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.872 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.434 ' HG3' HG22 ' A' ' 68' ' ' VAL . 2.1 tt0 -98.44 176.77 5.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.489 ' SG ' HD13 ' A' ' 40' ' ' LEU . 12.0 t -170.72 102.64 0.24 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.881 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.637 ' CE1' HD22 ' A' ' 66' ' ' LEU . 0.2 OUTLIER -83.2 82.98 8.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.032 -179.995 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.589 HG21 HG23 ' A' ' 30' ' ' VAL . 2.7 mp -61.65 -35.12 65.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.077 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.417 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 7.6 mmmt -131.03 169.32 14.02 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.673 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.417 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 16.9 Cg_exo -66.83 -5.29 12.95 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.634 2.223 . . . . 0.0 112.79 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -142.92 27.48 1.63 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.829 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.909 ' O ' HD23 ' A' ' 66' ' ' LEU . 98.0 t -135.52 137.98 48.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.177 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.909 HD23 ' O ' ' A' ' 65' ' ' VAL . 9.0 mt -139.86 93.79 2.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.794 179.559 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.64 HD12 ' N ' ' A' ' 68' ' ' VAL . 2.6 tp -92.36 119.24 31.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.844 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.64 ' N ' HD12 ' A' ' 67' ' ' LEU . 50.3 t -93.74 136.05 26.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.021 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.428 ' CZ ' ' HB2' ' A' ' 59' ' ' CYS . 2.2 p90 -147.8 158.61 44.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.759 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.741 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.4 OUTLIER -104.28 144.35 31.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.866 -179.968 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.521 ' HA ' HD12 ' A' ' 76' ' ' LEU . 8.7 p -82.83 158.96 3.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.021 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.506 ' N ' HG22 ' A' ' 71' ' ' VAL . 0.0 OUTLIER -157.44 155.84 31.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.926 179.599 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.67 107.29 0.49 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.003 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 58.29 23.41 10.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.116 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -158.1 154.66 27.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.886 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.521 HD12 ' HA ' ' A' ' 71' ' ' VAL . 4.6 tp -133.89 140.24 46.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.723 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.741 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.0 pp -122.64 134.61 65.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.189 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 71.3 mt -74.19 151.94 39.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.912 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.735 HD12 HH11 ' A' ' 80' ' ' ARG . 0.2 OUTLIER -112.62 -68.62 0.92 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.884 179.976 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.735 HH11 HD12 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -158.62 168.81 25.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.078 179.999 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.659 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.3 tm? -118.63 133.95 55.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.733 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.659 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -150.3 -164.57 11.96 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.58 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.4 p -144.48 171.78 13.88 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.724 0.297 . . . . 0.0 110.832 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.579 ' HA ' HD11 ' A' ' 66' ' ' LEU . 2.5 t-80 -58.65 -28.33 65.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.016 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.2 t -86.38 -30.05 22.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.94 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.37 -74.93 0.31 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.906 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.745 HD12 ' HB2' ' A' ' 66' ' ' LEU . 34.7 mt -60.25 -34.61 73.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.854 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.85 179.982 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.1 mt . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.722 0.296 . . . . 0.0 110.98 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.66 156.47 13.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.908 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.789 HD11 HD11 ' A' ' 78' ' ' LEU . 7.1 tt -124.68 151.37 45.03 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.977 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.662 ' HB2' HG22 ' A' ' 77' ' ' ILE . 1.4 t-20 -138.13 174.28 10.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.852 179.87 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.0 mt -127.67 142.58 51.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.871 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.5 mmpt? -112.93 164.55 13.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.907 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.3 pttt -54.71 -53.21 57.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.183 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.41 ' CB ' ' HB3' ' A' ' 80' ' ' ARG . 55.8 m -57.62 -37.68 73.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.121 -179.81 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.471 ' CZ ' HD13 ' A' ' 78' ' ' LEU . 36.0 t80 -62.45 -27.69 69.29 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.99 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -77.7 -38.47 47.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.092 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.412 ' O ' ' CB ' ' A' ' 16' ' ' LYS . 6.1 ptmt -89.96 -8.59 51.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.601 -179.778 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -90.44 -23.52 20.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.792 0.33 . . . . 0.0 111.116 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.591 ' HZ ' HD13 ' A' ' 27' ' ' LEU . 37.1 t80 -90.29 -68.86 0.76 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.439 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -49.96 -33.07 16.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.995 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.426 ' O ' ' ND2' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -79.45 -23.66 42.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.862 179.715 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.454 ' HG ' ' CG ' ' A' ' 22' ' ' PHE . 36.6 tp -86.46 -50.53 6.81 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.689 HD13 ' HD2' ' A' ' 22' ' ' PHE . 4.2 mm? -50.55 -36.08 32.77 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.1 179.749 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 27.0 mt -90.01 -7.75 53.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.798 -179.693 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.426 ' ND2' ' O ' ' A' ' 16' ' ' LYS . 3.1 m-20 -93.77 35.85 1.12 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.877 0.37 . . . . 0.0 111.149 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 80.11 22.85 62.42 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.684 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.689 ' HD2' HD13 ' A' ' 18' ' ' LEU . 71.7 t80 -98.72 107.96 20.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.783 0.325 . . . . 0.0 110.609 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.751 ' HB3' HG23 ' A' ' 26' ' ' VAL . 2.2 t0 -52.77 124.13 13.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.037 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.58 ' HA ' HD23 ' A' ' 27' ' ' LEU . 7.4 p-10 -62.43 -38.4 89.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.119 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.6 t -54.1 -24.59 18.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.245 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.751 HG23 ' HB3' ' A' ' 23' ' ' ASP . 34.5 t -79.61 -35.48 16.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.286 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.591 HD13 ' HZ ' ' A' ' 14' ' ' PHE . 1.0 OUTLIER -57.67 -35.99 71.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.954 -179.871 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.734 ' O ' HD22 ' A' ' 32' ' ' LEU . 6.1 t-20 -63.7 -15.86 59.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.36 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -90.1 -35.58 15.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.694 0.283 . . . . 0.0 111.328 -179.649 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.765 ' CG2' HD13 ' A' ' 61' ' ' ILE . 10.0 p -90.63 -36.05 7.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -179.325 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.643 ' CD1' HG13 ' A' ' 30' ' ' VAL . 1.6 mp -76.21 -42.07 37.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 111.642 0.238 . . . . 0.0 111.642 -179.163 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.761 HD23 ' N ' ' A' ' 33' ' ' THR . 0.4 OUTLIER -64.51 -14.37 56.97 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.447 -179.553 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.761 ' N ' HD23 ' A' ' 32' ' ' LEU . 99.9 m -90.36 -25.68 20.32 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 120.767 0.317 . . . . 0.0 110.904 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.8 mt -86.3 -36.78 19.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.555 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.6 mtp-105 -93.5 20.36 7.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.643 -179.522 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.54 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -126.85 18.71 7.24 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.598 0.222 . . . . 0.0 111.598 -179.793 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.458 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 12.4 pttm 45.72 30.01 0.76 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.907 0.384 . . . . 0.0 111.085 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.02 148.13 78.11 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.9 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -74.44 161.4 40.19 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.5 2.133 . . . . 0.0 112.463 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.2 mt -130.14 123.4 30.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.991 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.61 156.91 29.86 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.914 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -62.34 -24.17 75.63 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.543 2.162 . . . . 0.0 112.281 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -63.51 -23.7 67.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.037 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.423 ' O ' ' CD2' ' A' ' 60' ' ' HIS . 44.6 m-85 -69.34 -10.54 58.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.455 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 58.91 34.69 23.79 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.861 0.362 . . . . 0.0 111.066 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -66.4 78.11 0.1 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.837 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 73.1 m80 -138.95 177.62 7.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.019 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.31 137.02 44.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.09 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.537 HD13 ' HB3' ' A' ' 53' ' ' TRP . 0.4 OUTLIER -74.89 -171.09 1.22 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.819 179.906 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -144.1 149.78 37.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.929 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 65.98 109.17 0.01 OUTLIER Glycine 0 CA--C 1.506 -0.474 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.841 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.4 mptt 69.18 -45.95 0.56 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.528 0.204 . . . . 0.0 111.181 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.537 ' HB3' HD13 ' A' ' 49' ' ' LEU . 17.8 m95 -101.95 33.93 2.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.855 0.359 . . . . 0.0 111.073 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.464 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 22.9 tttm -64.15 -49.42 73.66 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.303 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.464 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 89.1 Cg_endo -79.76 46.89 2.35 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.362 2.041 . . . . 0.0 112.745 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.551 ' CE1' HD11 ' A' ' 79' ' ' LEU . 69.1 m-85 -153.02 -176.51 5.8 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.732 0.301 . . . . 0.0 110.962 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.407 ' NH1' ' HB2' ' A' ' 57' ' ' ARG . 18.5 ttm105 -137.33 141.99 41.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.153 -179.749 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -106.81 161.97 14.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.793 179.689 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 9.1 t -171.27 100.24 0.2 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.906 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.44 ' O ' ' CG ' ' A' ' 60' ' ' HIS . 26.8 p80 -86.58 108.56 18.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.067 0.461 . . . . 0.0 110.827 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.765 HD13 ' CG2' ' A' ' 30' ' ' VAL . 4.6 mp -77.53 -31.9 18.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.852 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.538 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 5.6 mmtp -128.05 161.5 55.61 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.293 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.538 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 29.0 Cg_endo -62.98 -6.02 8.73 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.307 2.005 . . . . 0.0 112.747 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -135.84 25.81 3.34 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.694 179.556 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.863 ' O ' HD23 ' A' ' 66' ' ' LEU . 54.8 t -137.33 146.76 27.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.137 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.863 HD23 ' O ' ' A' ' 65' ' ' VAL . 4.7 mt -144.25 102.94 3.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.731 179.6 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.649 ' C ' HD13 ' A' ' 67' ' ' LEU . 3.3 tm? -92.58 131.19 37.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.008 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.604 ' N ' HD13 ' A' ' 67' ' ' LEU . 87.5 t -109.84 115.59 50.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.828 178.78 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.485 ' HB3' HD11 ' A' ' 67' ' ' LEU . 27.2 p90 -128.19 149.96 50.22 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.268 -179.073 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.793 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.4 OUTLIER -113.73 155.23 25.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.857 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.578 ' H ' HD23 ' A' ' 70' ' ' LEU . 21.5 t -107.04 129.95 59.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.176 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.47 173.2 7.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.784 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -56.92 101.93 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.912 0.387 . . . . 0.0 110.981 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 54.85 23.48 4.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.149 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -150.68 133.91 16.2 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.938 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.464 HD12 ' HA ' ' A' ' 71' ' ' VAL . 6.6 tp -105.04 152.09 23.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.755 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.793 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.0 pp -138.29 142.89 34.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.429 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.789 HD11 HD11 ' A' ' 4' ' ' LEU . 58.1 mt -93.81 123.31 37.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.434 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.589 HD11 HD12 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -77.44 -60.37 2.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.078 -179.635 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.41 ' HB3' ' CB ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -173.87 167.05 4.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.081 0.467 . . . . 0.0 111.65 179.949 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.898 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.9 tm? -116.8 143.52 45.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.582 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.898 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -165.93 -165.63 23.59 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.841 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.0 p -138.84 -178.84 5.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.764 0.316 . . . . 0.0 110.795 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -62.89 -23.42 67.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.182 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.7 m -83.29 -30.19 27.76 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.163 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -86.03 -67.95 0.77 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.014 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.485 HD13 HD12 ' A' ' 66' ' ' LEU . 4.6 mp -56.15 -32.39 64.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.055 -179.762 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.941 -179.96 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 7.1 mt . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.924 0.393 . . . . 0.0 110.835 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.61 145.95 50.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.824 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -113.59 151.43 31.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.945 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.829 ' HB2' HG22 ' A' ' 77' ' ' ILE . 2.7 t30 -137.13 -173.01 3.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.764 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.0 mp -144.73 136.84 26.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.976 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.55 172.7 6.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.938 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.2 mtmt -67.96 -46.16 72.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.949 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 35.3 m -59.69 -42.41 92.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.872 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.509 ' CE1' HD13 ' A' ' 67' ' ' LEU . 11.5 t80 -60.54 -36.85 79.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.746 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -63.53 -47.47 81.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.845 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.578 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 9.7 mttt -72.6 -23.47 60.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.102 0.477 . . . . 0.0 111.027 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.428 ' C ' ' HB2' ' A' ' 17' ' ' LEU . 82.7 m-20 -90.41 -10.28 44.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.057 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.559 ' O ' HD21 ' A' ' 18' ' ' LEU . 10.1 t80 -90.85 -68.4 0.79 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.904 179.757 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -91.38 -36.7 13.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.214 -179.489 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.578 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 2.1 ttmt -76.21 -16.58 59.8 Favored 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 120.89 -0.324 . . . . 0.0 111.689 -178.709 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.431 HD22 ' HB2' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -81.88 -35.31 29.4 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.137 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.821 HD13 ' CB ' ' A' ' 24' ' ' ASP . 1.4 mt -61.53 -35.76 78.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.952 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 pp -89.93 11.58 20.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.348 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -114.06 28.69 8.56 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.859 0.362 . . . . 0.0 110.945 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.04 25.03 32.84 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.647 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.441 ' CD2' ' N ' ' A' ' 23' ' ' ASP . 50.9 t80 -115.09 164.22 14.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.775 0.321 . . . . 0.0 110.872 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.633 ' HB3' HG23 ' A' ' 26' ' ' VAL . 11.9 t70 -98.65 114.99 27.69 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.965 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.821 ' CB ' HD13 ' A' ' 18' ' ' LEU . 6.8 p-10 -66.44 -31.16 71.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.893 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.1 t -56.7 -37.0 70.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.186 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.633 HG23 ' HB3' ' A' ' 23' ' ' ASP . 46.9 t -60.76 -35.71 66.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.204 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.442 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.6 OUTLIER -65.48 -33.76 76.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.791 -179.815 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.819 ' O ' HD22 ' A' ' 32' ' ' LEU . 8.1 t-20 -65.9 -14.38 61.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.4 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.445 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 3.1 mt-10 -90.14 -33.76 16.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.731 0.301 . . . . 0.0 111.113 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 1.13 HG23 HG21 ' A' ' 61' ' ' ILE . 8.0 p -90.82 -43.06 14.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.659 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.753 HD12 HG13 ' A' ' 30' ' ' VAL . 1.6 mp -62.26 -57.73 10.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.639 -179.248 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.819 HD22 ' O ' ' A' ' 28' ' ' ASN . 0.9 OUTLIER -49.55 -21.43 0.98 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -178.855 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.669 ' N ' HD23 ' A' ' 32' ' ' LEU . 89.1 m -90.08 -34.23 16.0 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.676 0.274 . . . . 0.0 111.24 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.85 HD21 HD21 ' A' ' 40' ' ' LEU . 83.0 mt -86.43 -30.84 21.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.668 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.491 ' HG3' HG23 ' A' ' 31' ' ' ILE . 2.2 mtt85 -92.38 20.18 6.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.745 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.591 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -113.74 -50.94 2.82 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.796 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.543 ' H ' ' HG3' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 153.93 -20.65 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 122.699 0.4 . . . . 0.0 111.008 179.752 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.458 ' OE1' HG23 ' A' ' 33' ' ' THR . 24.4 tt0 -64.08 111.44 5.44 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.173 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -78.82 131.48 10.19 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.508 2.139 . . . . 0.0 112.273 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.85 HD21 HD21 ' A' ' 34' ' ' LEU . 6.7 mt -59.57 166.95 2.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.926 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -108.73 163.28 17.33 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.09 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.94 -12.75 31.08 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.618 2.212 . . . . 0.0 112.545 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 -82.91 2.95 31.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.374 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -95.23 20.97 8.47 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.708 0.29 . . . . 0.0 111.185 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 61.18 46.72 7.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.897 0.379 . . . . 0.0 111.037 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.4 p-10 -89.52 96.61 10.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.937 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 21.6 p-80 -152.08 -178.07 6.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.931 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -87.02 128.48 35.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.13 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.599 ' H ' HD12 ' A' ' 49' ' ' LEU . 4.6 mp -65.62 -175.78 0.3 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.889 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.1 mtmt -117.34 161.19 19.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.898 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.95 -116.52 4.68 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.575 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.14 -14.75 21.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.601 0.239 . . . . 0.0 111.313 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 19.3 m95 -96.24 31.08 2.28 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.061 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.4 OUTLIER -75.53 -51.44 3.2 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.028 179.844 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 50.9 Cg_exo -54.01 -18.69 13.83 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.424 2.082 . . . . 0.0 112.437 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -98.89 175.07 6.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.854 0.359 . . . . 0.0 110.992 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.653 HH21 HG21 ' A' ' 71' ' ' VAL . 0.3 OUTLIER -128.61 132.54 48.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.877 179.888 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.447 ' HG3' HD21 ' A' ' 49' ' ' LEU . 2.4 tt0 -95.96 172.76 7.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.072 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 3.2 t -170.18 116.19 0.52 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.638 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.6 m170 -88.57 84.62 6.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.111 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 1.13 HG21 HG23 ' A' ' 30' ' ' VAL . 3.5 mp -59.05 -27.89 37.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.85 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.439 ' HB2' HG23 ' A' ' 65' ' ' VAL . 7.1 mttp -139.62 168.92 13.47 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.538 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.418 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 17.2 Cg_exo -66.92 -2.93 8.65 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.653 2.235 . . . . 0.0 112.884 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -145.42 29.56 1.15 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.914 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.88 ' O ' HD23 ' A' ' 66' ' ' LEU . 42.2 t -139.6 151.25 22.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.215 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.88 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.0 OUTLIER -157.09 104.09 2.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.595 179.812 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.509 HD13 ' CE1' ' A' ' 10' ' ' PHE . 1.1 tp -105.2 116.65 32.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.669 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.446 HG22 ' HG3' ' A' ' 58' ' ' GLU . 34.1 t -85.43 141.86 13.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.222 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.637 ' CD1' HD11 ' A' ' 76' ' ' LEU . 38.3 p90 -147.41 163.6 35.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.963 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.762 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.3 OUTLIER -112.82 157.14 21.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.867 179.98 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.663 ' H ' HD23 ' A' ' 70' ' ' LEU . 21.5 t -111.44 115.02 48.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.099 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.1 163.62 16.13 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.857 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -42.75 -35.61 1.2 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.55 -179.76 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -156.62 26.53 0.34 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.084 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -149.37 155.88 41.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.768 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.637 HD11 ' CD1' ' A' ' 69' ' ' TYR . 9.8 tp -113.73 132.16 55.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.723 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.829 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.2 pp -126.3 130.39 71.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.367 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 72.7 mt -74.13 142.18 45.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.637 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.82 -75.55 0.56 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.169 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.5 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -146.95 179.6 7.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.84 0.352 . . . . 0.0 111.287 -179.724 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.597 ' C ' HD13 ' A' ' 81' ' ' LEU . 2.9 tm? -139.6 134.9 32.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.765 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.516 ' H ' HD22 ' A' ' 81' ' ' LEU . . . -179.73 176.53 47.62 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.586 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.435 ' C ' HD11 ' A' ' 66' ' ' LEU . 14.6 m -112.42 175.32 5.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.829 0.347 . . . . 0.0 110.827 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.57 ' N ' HD11 ' A' ' 66' ' ' LEU . 46.7 t-80 -59.79 -32.04 70.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.852 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -78.77 -21.32 48.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.045 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.15 -49.69 6.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.833 0.349 . . . . 0.0 110.845 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.6 HD12 HD12 ' A' ' 66' ' ' LEU . 12.4 mt -82.4 -40.94 20.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.977 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.935 -179.964 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.93 HD12 ' HB2' ' A' ' 76' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.768 0.318 . . . . 0.0 110.895 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.45 152.53 21.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.029 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 7.7 tt -128.54 138.43 52.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.744 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.688 ' HB2' HG22 ' A' ' 77' ' ' ILE . 4.9 t30 -119.59 179.06 4.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.987 -179.894 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.454 HD11 ' NH2' ' A' ' 35' ' ' ARG . 0.6 OUTLIER -147.08 122.74 10.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.818 179.974 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.528 ' NZ ' HD13 ' A' ' 77' ' ' ILE . 8.4 mttp -103.17 169.3 8.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.871 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 7.0 tttt -65.83 -43.58 88.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.855 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.5 m -58.76 -29.88 67.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.974 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.551 ' HE1' HD13 ' A' ' 67' ' ' LEU . 38.7 t80 -77.14 -41.56 41.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.949 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -58.82 -45.13 90.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.866 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.476 ' O ' ' N ' ' A' ' 16' ' ' LYS . 2.7 mmmt -73.51 -45.06 56.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.026 0.441 . . . . 0.0 110.717 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.58 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -49.3 -25.76 2.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.982 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.617 ' CE1' HD22 ' A' ' 27' ' ' LEU . 75.9 t80 -91.49 -72.47 0.58 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.033 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.553 ' HA ' HD12 ' A' ' 18' ' ' LEU . 9.1 t70 -51.01 -45.3 61.16 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.357 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.476 ' N ' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -72.94 -13.5 61.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.36 -179.853 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.58 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 5.6 mt -90.34 -53.49 4.43 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 121.025 0.44 . . . . 0.0 110.356 179.474 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.553 HD12 ' HA ' ' A' ' 15' ' ' ASP . 0.5 OUTLIER -52.32 -33.87 44.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.219 -179.855 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.654 ' O ' HD12 ' A' ' 19' ' ' LEU . 4.3 pp -90.06 13.94 13.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.237 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -123.79 13.29 9.24 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.556 0.217 . . . . 0.0 111.406 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.41 29.16 5.77 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.787 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -110.73 118.13 35.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.888 0.375 . . . . 0.0 110.779 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.717 ' HB3' HG23 ' A' ' 26' ' ' VAL . 1.2 t70 -58.51 119.89 7.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.871 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.597 ' HA ' HD23 ' A' ' 27' ' ' LEU . 3.5 p-10 -66.17 -30.3 70.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.952 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 94.1 p -57.23 -27.51 62.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.153 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.717 HG23 ' HB3' ' A' ' 23' ' ' ASP . 31.4 t -71.96 -37.83 62.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.336 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.617 HD22 ' CE1' ' A' ' 14' ' ' PHE . 1.0 OUTLIER -59.76 -34.94 73.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.02 -179.819 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.533 ' O ' HD22 ' A' ' 32' ' ' LEU . 6.0 t-20 -61.25 -18.15 56.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.283 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.413 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 51.1 mt-10 -88.98 -35.76 16.22 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.78 0.324 . . . . 0.0 111.331 -179.759 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.916 HG13 HD12 ' A' ' 31' ' ' ILE . 15.0 p -90.69 -31.13 5.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.932 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.916 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -75.35 -47.98 32.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.658 -179.364 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.623 HD23 ' N ' ' A' ' 33' ' ' THR . 0.6 OUTLIER -56.34 -22.69 32.48 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.134 -179.539 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.623 ' N ' HD23 ' A' ' 32' ' ' LEU . 94.4 m -85.39 -27.39 25.84 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.673 0.273 . . . . 0.0 111.208 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.2 mt -84.64 -33.72 23.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.312 -179.471 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.454 ' NH2' HD11 ' A' ' 6' ' ' LEU . 1.0 OUTLIER -96.68 20.35 10.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.303 -179.89 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.542 ' O ' ' HG3' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -119.29 27.08 9.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.409 -179.768 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.542 ' HG3' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 35.6 36.14 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.67 -179.906 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -102.79 132.71 20.96 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.667 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -74.66 138.31 23.75 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.407 2.071 . . . . 0.0 112.524 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 6.0 mt -88.22 134.49 33.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.702 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -61.79 152.94 74.19 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.007 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.64 -8.25 23.18 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.532 2.155 . . . . 0.0 112.682 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.14 6.76 27.76 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.344 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -90.02 9.12 29.21 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.583 0.23 . . . . 0.0 111.316 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 36.2 mm-40 57.77 41.01 25.73 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.939 0.399 . . . . 0.0 111.057 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -87.54 86.56 7.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.984 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -139.84 -172.0 3.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.952 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.58 148.77 44.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.199 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.46 HD13 ' HB2' ' A' ' 56' ' ' PHE . 1.7 mp -84.74 177.68 7.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.875 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.18 156.76 22.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.89 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.95 -131.46 10.75 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.609 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.42 -13.92 50.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.56 0.219 . . . . 0.0 111.276 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 8.9 m95 -95.49 23.83 5.68 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.661 0.267 . . . . 0.0 111.291 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.463 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.4 OUTLIER -60.67 -49.16 90.95 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.047 179.988 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.463 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 36.9 Cg_exo -57.42 -16.85 24.73 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.449 2.099 . . . . 0.0 112.43 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.46 ' HB2' HD13 ' A' ' 49' ' ' LEU . 96.7 m-85 -93.3 176.31 6.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.867 0.365 . . . . 0.0 111.02 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.527 ' O ' HG13 ' A' ' 68' ' ' VAL . 22.2 ttm180 -132.29 137.88 47.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.899 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.406 ' HG3' HG22 ' A' ' 68' ' ' VAL . 3.8 tt0 -95.91 176.19 6.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.046 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 3.0 t -169.06 107.01 0.43 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.888 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -92.08 77.4 5.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.847 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.525 ' H ' HD12 ' A' ' 61' ' ' ILE . 4.3 mp -58.28 -28.97 36.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.061 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.402 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 1.3 mtpm? -139.06 169.47 12.38 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.875 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.402 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 11.3 Cg_exo -70.7 -2.47 10.9 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.77 2.313 . . . . 0.0 112.838 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -139.55 27.1 2.29 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.836 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.798 ' O ' HD23 ' A' ' 66' ' ' LEU . 46.2 t -140.13 149.97 21.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.016 0.436 . . . . 0.0 111.1 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.798 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.8 OUTLIER -148.6 91.46 1.89 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.608 179.87 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.739 HD12 ' N ' ' A' ' 68' ' ' VAL . 2.4 tp -91.42 122.76 34.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.962 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.739 ' N ' HD12 ' A' ' 67' ' ' LEU . 56.0 t -99.15 133.46 41.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.912 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.775 ' CD1' HD11 ' A' ' 76' ' ' LEU . 23.7 p90 -140.95 172.49 12.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.92 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.639 ' HB2' HD11 ' A' ' 77' ' ' ILE . 5.7 tp -118.5 136.12 54.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.872 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.515 HG22 ' N ' ' A' ' 72' ' ' LYS . 8.7 p -80.67 159.29 4.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.172 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.515 ' N ' HG22 ' A' ' 71' ' ' VAL . 0.0 OUTLIER -143.75 156.54 44.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.895 179.381 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -40.9 -32.3 0.22 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.837 -179.6 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -165.6 33.57 0.05 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.759 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -156.67 163.5 39.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.949 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.93 ' HB2' HD12 ' A' ' 2' ' ' LEU . 11.8 tp -125.9 139.62 53.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.712 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.688 HG22 ' HB2' ' A' ' 5' ' ' ASN . 1.8 pp -129.46 129.8 67.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.171 -179.853 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.542 HD13 ' CE2' ' A' ' 10' ' ' PHE . 66.8 mt -73.29 146.22 45.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.882 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.425 ' HG ' ' CD2' ' A' ' 56' ' ' PHE . 0.1 OUTLIER -112.98 -70.75 0.79 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.009 -179.891 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.87 157.48 37.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.041 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.581 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.4 tm? -111.49 133.7 53.59 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.032 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.581 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -136.99 -167.91 11.24 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.371 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.6 m -151.13 162.23 41.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.844 0.354 . . . . 0.0 110.795 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -55.75 -28.0 53.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.752 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 64.8 m -89.93 -27.43 19.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.826 179.677 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.06 -70.91 0.47 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.987 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.584 HD12 ' HB2' ' A' ' 66' ' ' LEU . 17.9 mt -68.81 -37.07 78.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.967 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.884 179.968 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.465 HD12 ' CB ' ' A' ' 76' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.774 0.321 . . . . 0.0 110.845 . . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.63 150.51 32.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.973 -179.958 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.646 HD11 HD11 ' A' ' 78' ' ' LEU . 9.0 tt -119.33 148.08 43.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.833 179.945 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.743 ' HB2' HG22 ' A' ' 77' ' ' ILE . 4.9 t30 -135.14 -177.58 4.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.9 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.512 HD11 ' NH2' ' A' ' 35' ' ' ARG . 17.2 mt -146.73 133.6 20.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.975 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.4 mmmt -104.34 174.76 5.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.969 179.94 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.7 tttm -64.98 -33.11 75.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.951 -179.975 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 m -69.52 -46.62 66.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.972 179.96 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.612 ' CE1' HD13 ' A' ' 67' ' ' LEU . 23.5 t80 -59.74 -30.08 68.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.98 -179.994 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -60.42 -46.12 91.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.0 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.499 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 0.7 OUTLIER -73.85 -19.85 60.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.047 0.451 . . . . 0.0 111.174 -179.993 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.426 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 74.2 m-20 -90.46 -16.96 27.99 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.984 179.708 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.589 ' O ' HD13 ' A' ' 18' ' ' LEU . 20.4 t80 -90.99 -68.54 0.78 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.434 -179.506 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.801 ' HA ' HD22 ' A' ' 18' ' ' LEU . 38.8 t70 -91.01 -40.51 11.61 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -178.903 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.499 ' HB3' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -70.89 -24.8 62.55 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.35 -178.979 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.426 ' HB2' ' HA ' ' A' ' 13' ' ' ASP . 27.4 tp -72.54 -34.47 67.56 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 179.151 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.801 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.1 OUTLIER -57.63 -31.11 65.92 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.733 179.859 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 14.4 mt -89.97 -6.56 55.53 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.442 -179.984 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.68 28.3 3.48 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.732 0.301 . . . . 0.0 111.105 -179.861 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 92.89 23.05 26.43 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.814 179.804 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.502 ' CD1' HD12 ' A' ' 18' ' ' LEU . 11.1 t80 -113.79 135.44 53.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.857 0.361 . . . . 0.0 110.768 179.81 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.414 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 18.6 t0 -93.39 122.1 35.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.923 -179.98 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -58.3 -20.57 43.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.429 179.959 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 t -50.57 -55.42 16.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.732 0.301 . . . . 0.0 111.195 -179.88 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 37.9 t -67.2 -34.87 72.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.079 -179.952 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.839 ' CD1' HD13 ' A' ' 31' ' ' ILE . 5.4 tp -62.99 -29.93 71.2 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.715 179.949 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.581 ' O ' HD22 ' A' ' 32' ' ' LEU . 47.3 t30 -63.5 -22.88 67.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.212 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.481 ' HA ' HD22 ' A' ' 32' ' ' LEU . 3.6 mt-10 -87.07 -18.16 31.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.351 -179.896 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.708 HG13 HG21 ' A' ' 61' ' ' ILE . 66.3 t -90.26 -69.53 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.003 0.43 . . . . 0.0 111.613 -179.705 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.839 HD13 ' CD1' ' A' ' 27' ' ' LEU . 1.2 mp -48.42 -44.01 13.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.231 -178.975 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.583 HD23 ' N ' ' A' ' 33' ' ' THR . 0.4 OUTLIER -60.8 -15.94 35.4 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 121.079 -0.248 . . . . 0.0 111.568 -179.418 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.583 ' N ' HD23 ' A' ' 32' ' ' LEU . 85.7 m -90.08 -36.27 14.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.759 0.314 . . . . 0.0 111.025 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.9 mt -82.34 -29.61 30.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.331 -179.586 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.512 ' NH2' HD11 ' A' ' 6' ' ' LEU . 22.0 mtt180 -94.62 20.31 8.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.398 -179.76 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.474 ' O ' ' CG ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -126.68 26.76 6.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.068 -179.822 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.474 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 0.6 OUTLIER 47.33 53.67 10.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.178 -179.82 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -128.45 102.78 20.31 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.703 179.944 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -68.09 136.67 38.53 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.396 2.064 . . . . 0.0 112.341 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.625 HD13 ' SG ' ' A' ' 59' ' ' CYS . 1.2 mp -74.1 158.21 34.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.993 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.19 164.28 53.15 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.005 -179.909 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.53 -13.34 38.72 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.61 2.207 . . . . 0.0 112.487 179.941 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -86.89 7.49 27.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.421 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -93.53 14.17 19.61 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.109 179.941 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 58.76 38.69 24.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.91 0.386 . . . . 0.0 111.057 179.979 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.9 p-10 -83.62 79.74 9.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.892 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -137.43 176.11 9.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.94 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.69 152.45 37.51 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.143 -179.905 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.467 HD11 ' HG3' ' A' ' 58' ' ' GLU . 8.1 mt -97.15 -176.67 3.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.785 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -135.24 155.68 50.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.995 0.426 . . . . 0.0 110.899 -179.979 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 60.4 106.35 0.01 OUTLIER Glycine 0 CA--C 1.508 -0.387 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.704 179.951 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.53 -46.77 0.59 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.63 0.252 . . . . 0.0 111.074 179.939 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 62.3 m95 -99.63 33.33 2.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.823 0.344 . . . . 0.0 111.018 -179.881 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.44 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -71.63 -50.83 9.88 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.899 -179.948 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.44 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 14.1 Cg_exo -68.74 -7.08 19.55 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.639 2.226 . . . . 0.0 112.43 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.464 ' CD2' HD13 ' A' ' 70' ' ' LEU . 69.5 m-85 -102.2 178.3 4.64 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.949 0.404 . . . . 0.0 111.071 -179.785 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.627 ' O ' HG13 ' A' ' 68' ' ' VAL . 0.1 OUTLIER -137.47 144.64 42.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.726 -179.984 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.545 ' HG3' HG22 ' A' ' 68' ' ' VAL . 1.5 tt0 -107.18 168.57 9.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.998 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.625 ' SG ' HD13 ' A' ' 40' ' ' LEU . 15.0 t -168.33 123.8 0.98 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.896 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 9.1 m170 -93.28 93.17 8.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.97 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.708 HG21 HG13 ' A' ' 30' ' ' VAL . 4.4 mp -60.1 -31.56 48.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.861 179.895 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.442 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 6.1 mtpp -145.89 172.5 5.21 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.622 -179.932 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.442 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 17.4 Cg_exo -66.38 -4.29 10.39 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.672 2.248 . . . . 0.0 112.856 -179.888 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -142.02 29.07 1.68 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.861 179.792 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.518 ' C ' HD23 ' A' ' 66' ' ' LEU . 61.2 t -149.39 143.29 18.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.257 -180.0 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.789 HD12 HD13 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -159.13 118.71 3.03 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.683 179.961 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.612 HD13 ' CE1' ' A' ' 10' ' ' PHE . 0.2 OUTLIER -120.48 136.69 54.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.85 0.357 . . . . 0.0 110.968 -179.934 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.627 HG13 ' O ' ' A' ' 57' ' ' ARG . 57.1 t -91.53 137.13 22.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.894 -179.958 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -135.49 172.95 12.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.858 179.934 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.78 ' HB2' HD11 ' A' ' 77' ' ' ILE . 5.0 tp -117.23 162.23 18.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.905 -179.971 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.6 t -106.03 113.38 42.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.12 179.967 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -109.28 159.82 16.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.89 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -58.6 106.44 0.4 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.9 179.969 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.5 t70 57.4 26.59 12.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.101 -179.809 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -157.78 148.7 21.13 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.855 -179.988 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.465 ' CB ' HD12 ' A' ' 2' ' ' LEU . 7.6 tp -120.72 138.12 54.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.834 179.974 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.78 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.2 pp -124.84 135.61 63.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.198 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.646 HD11 HD11 ' A' ' 4' ' ' LEU . 58.4 mt -80.04 142.78 34.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.735 179.789 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.415 ' HG ' ' CD2' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -103.89 -71.69 0.72 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.06 -179.789 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.91 161.07 40.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.882 0.373 . . . . 0.0 111.349 -179.841 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.705 HD22 ' N ' ' A' ' 82' ' ' GLY . 1.7 tm? -123.73 133.44 53.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.635 179.911 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.705 ' N ' HD22 ' A' ' 81' ' ' LEU . . . -155.03 -176.95 27.82 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.572 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.7 t -121.5 172.31 8.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.803 0.335 . . . . 0.0 110.936 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -60.06 -28.41 67.77 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.873 179.988 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 49.3 p -82.86 -21.62 34.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.157 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.68 -66.81 0.86 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.809 0.338 . . . . 0.0 111.015 -179.827 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.789 HD13 HD12 ' A' ' 66' ' ' LEU . 6.7 mp -57.69 -37.15 72.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.084 -179.818 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.86 -179.934 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 6.6 mt . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.843 0.354 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.89 150.54 45.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.863 179.875 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.741 HD11 HD11 ' A' ' 78' ' ' LEU . 7.6 tt -119.51 150.16 40.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.971 179.957 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.768 ' HB2' HG22 ' A' ' 77' ' ' ILE . 2.9 t30 -136.47 170.38 16.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.918 179.989 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 39.4 mt -131.18 117.76 19.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.798 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -87.61 165.68 15.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.947 179.911 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.0 mttt -66.89 -40.12 87.67 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.83 -179.973 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.9 t -58.96 -35.77 73.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.965 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 39.7 t80 -61.42 -30.16 70.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.008 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -75.95 -33.98 59.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.92 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.434 ' O ' ' CB ' ' A' ' 16' ' ' LYS . 60.6 mttt -89.98 -14.16 34.6 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.199 179.853 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.456 ' O ' ' CB ' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -90.31 -21.18 22.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.971 0.415 . . . . 0.0 110.434 179.394 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.506 ' O ' HD12 ' A' ' 18' ' ' LEU . 40.8 t80 -91.4 -74.65 0.5 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.951 179.461 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.552 ' HA ' HD12 ' A' ' 18' ' ' LEU . 0.2 OUTLIER -51.07 -47.99 61.69 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.781 -179.967 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.442 ' HA ' HD21 ' A' ' 19' ' ' LEU . 1.6 tppt? -71.87 -13.3 61.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.69 -179.455 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.463 ' HG ' ' CB ' ' A' ' 22' ' ' PHE . 28.3 tp -90.64 -51.31 5.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.933 0.397 . . . . 0.0 110.348 179.837 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.552 HD12 ' HA ' ' A' ' 15' ' ' ASP . 0.4 OUTLIER -55.76 -34.63 65.38 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.344 -179.904 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.575 ' C ' HD12 ' A' ' 19' ' ' LEU . 4.0 pp -80.81 -10.7 59.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.224 179.874 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.12 23.14 6.79 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.732 0.301 . . . . 0.0 111.203 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.73 42.36 7.78 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.725 179.806 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.467 ' HB3' ' HA ' ' A' ' 18' ' ' LEU . 89.2 t80 -114.5 122.49 46.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.823 0.344 . . . . 0.0 110.879 179.814 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.475 ' HB3' HG23 ' A' ' 26' ' ' VAL . 1.1 t70 -61.32 103.39 0.3 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.838 -179.979 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.868 ' HA ' HD23 ' A' ' 27' ' ' LEU . 3.1 p30 -64.01 -24.42 67.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.128 -179.914 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.2 m -61.68 -47.52 84.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.236 -179.77 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.475 HG23 ' HB3' ' A' ' 23' ' ' ASP . 39.9 t -56.03 -43.89 76.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.313 -179.682 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.868 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.4 OUTLIER -59.83 -30.4 68.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.825 -179.963 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.679 ' O ' HD22 ' A' ' 32' ' ' LEU . 5.2 t-20 -53.45 -32.01 48.05 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.677 179.835 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.456 ' C ' HD22 ' A' ' 32' ' ' LEU . 1.7 mm-40 -75.71 -20.24 58.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.865 179.677 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.828 HG21 HG11 ' A' ' 65' ' ' VAL . 87.0 t -90.52 -74.0 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.761 -179.695 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.6 mp -44.11 -45.53 2.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.452 -178.985 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.821 HD23 ' N ' ' A' ' 33' ' ' THR . 0.4 OUTLIER -58.92 -16.69 18.91 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.864 -0.334 . . . . 0.0 111.531 -179.453 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.821 ' N ' HD23 ' A' ' 32' ' ' LEU . 65.2 m -90.0 -27.63 19.63 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 120.79 0.328 . . . . 0.0 110.785 179.689 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 30.1 mt -85.92 -33.42 21.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.241 -179.728 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.0 mtm180 -94.69 20.28 8.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.4 -179.74 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.442 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.1 OUTLIER -122.72 22.3 9.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.374 -179.867 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.434 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 0.6 OUTLIER 45.38 45.83 10.22 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.293 -179.946 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -117.46 127.97 26.32 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.798 -179.992 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.51 154.58 55.31 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.436 2.09 . . . . 0.0 112.257 -179.983 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.535 HD22 ' SG ' ' A' ' 59' ' ' CYS . 3.5 mp -102.46 146.32 28.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.92 179.972 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -66.79 158.58 79.48 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.922 179.918 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.51 -29.05 53.26 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.51 2.14 . . . . 0.0 112.18 179.949 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.36 -20.42 62.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.062 179.966 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.498 ' CE2' HD23 ' A' ' 40' ' ' LEU . 4.0 m-85 -61.3 -23.52 65.76 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.035 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 62.05 42.19 10.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.955 -179.991 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -75.54 84.08 2.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.845 179.932 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -134.02 -168.67 2.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.87 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -84.33 138.29 32.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.251 179.931 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.448 HD11 ' HB2' ' A' ' 58' ' ' GLU . 3.0 mp -76.75 -174.15 2.91 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.837 179.966 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.4 mttm -125.23 153.71 42.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.879 179.962 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 96.32 -113.71 4.74 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.644 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.1 -19.56 20.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.602 0.239 . . . . 0.0 111.15 -179.871 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.412 ' HB2' ' HB2' ' A' ' 49' ' ' LEU . 36.3 m95 -96.37 30.64 2.46 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.87 0.367 . . . . 0.0 110.945 -179.963 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.535 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 2.6 mtpt -69.48 -54.77 10.49 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.536 -179.874 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 21.7 Cg_endo -61.37 -10.42 15.89 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.293 1.995 . . . . 0.0 112.788 -179.799 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.611 ' CE1' HD21 ' A' ' 79' ' ' LEU . 47.4 m-85 -104.75 172.31 6.86 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.874 0.368 . . . . 0.0 110.918 179.818 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.419 ' O ' HG13 ' A' ' 68' ' ' VAL . 1.3 ttm180 -120.31 158.29 27.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.783 -179.813 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.448 ' HB2' HD11 ' A' ' 49' ' ' LEU . 6.8 tp10 -123.95 162.96 22.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.036 -179.92 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.535 ' SG ' HD22 ' A' ' 40' ' ' LEU . 1.1 t -154.97 112.24 3.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.754 179.933 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -86.02 71.16 10.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 -179.88 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.75 HD11 ' HB3' ' A' ' 67' ' ' LEU . 3.8 mp -59.08 -27.14 35.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.07 179.818 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.415 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 3.3 mttp -148.73 164.77 20.02 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.637 -179.804 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.415 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 42.0 Cg_endo -67.4 -3.22 9.65 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.447 2.098 . . . . 0.0 112.848 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -139.19 26.71 2.39 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.675 179.708 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.828 HG11 HG21 ' A' ' 30' ' ' VAL . 52.1 t -143.42 146.16 21.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.264 -179.909 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.807 HD23 ' O ' ' A' ' 65' ' ' VAL . 1.7 mt -147.95 96.58 2.67 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.718 179.855 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.765 HD22 ' N ' ' A' ' 68' ' ' VAL . 1.4 tm? -84.51 134.87 34.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.01 -179.986 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.765 ' N ' HD22 ' A' ' 67' ' ' LEU . 94.7 t -106.83 119.83 57.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.399 179.261 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.735 ' CD2' HD11 ' A' ' 76' ' ' LEU . 13.6 p90 -136.13 178.32 7.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.062 -179.498 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.763 ' HB2' HD11 ' A' ' 77' ' ' ILE . 5.2 tp -130.29 168.5 16.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.914 179.977 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -120.47 110.01 27.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.117 -179.981 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.87 176.48 5.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.778 179.986 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -59.78 103.16 0.19 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.905 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 55.89 24.52 7.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.119 -179.855 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -149.61 153.56 37.26 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.91 -179.957 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.735 HD11 ' CD2' ' A' ' 69' ' ' TYR . 8.0 tt -123.88 144.14 49.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.684 179.853 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.768 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.5 pp -129.33 138.05 55.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.315 -179.788 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.741 HD11 HD11 ' A' ' 4' ' ' LEU . 89.6 mt -86.58 131.46 34.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.553 179.625 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.611 HD21 ' CE1' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -91.78 -74.17 0.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.104 -179.607 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.619 ' NH1' HD21 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -155.75 177.68 11.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.874 0.369 . . . . 0.0 111.345 -179.845 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.766 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.5 tm? -119.2 134.76 55.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.93 -179.885 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.766 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -140.61 -173.18 13.3 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.538 179.961 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.9 m -144.58 171.07 14.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.867 0.365 . . . . 0.0 110.99 -179.968 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -59.68 -28.45 67.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.95 179.91 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.2 m -87.83 -26.31 22.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.087 -179.985 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -80.67 -70.21 0.54 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.912 -179.932 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.807 HD12 HD12 ' A' ' 66' ' ' LEU . 1.0 OUTLIER -70.25 -38.29 75.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.01 -179.908 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.919 179.984 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.5 mt . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.836 0.35 . . . . 0.0 111.015 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.12 150.72 28.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.851 179.927 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.547 HD11 HD11 ' A' ' 78' ' ' LEU . 1.7 tt -116.06 147.5 41.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.916 179.996 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.819 ' HB2' HG22 ' A' ' 77' ' ' ILE . 2.3 t30 -133.9 -178.39 5.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.943 179.945 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.3 mt -142.82 112.14 6.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.874 -179.93 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.2 mmtp -85.61 161.63 19.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.88 -179.997 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 17.4 mmtm -62.06 -30.85 71.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.951 179.969 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.0 t -72.15 -33.27 67.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.98 179.929 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.739 ' HE1' HD13 ' A' ' 67' ' ' LEU . 43.6 t80 -73.97 -31.1 62.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.904 -179.936 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -65.39 -40.72 93.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.929 179.977 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 17.5 mttt -88.63 -11.17 46.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.317 179.962 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.407 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 1.2 m-20 -90.44 -26.21 19.96 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.828 0.347 . . . . 0.0 110.415 179.516 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.791 ' O ' HD13 ' A' ' 18' ' ' LEU . 66.4 t80 -91.09 -70.71 0.67 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.177 179.866 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.702 ' HA ' HD22 ' A' ' 18' ' ' LEU . 4.2 t0 -62.6 -52.47 63.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.833 -179.197 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -62.41 -17.68 59.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.62 -179.279 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.407 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 44.9 tp -90.23 -40.94 11.87 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.075 0.464 . . . . 0.0 110.34 179.566 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.791 HD13 ' O ' ' A' ' 14' ' ' PHE . 0.0 OUTLIER -48.86 -45.26 40.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.192 -179.705 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.1 mt -90.06 0.79 56.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.802 -179.482 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -97.92 30.79 2.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.853 0.359 . . . . 0.0 111.003 -179.984 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 92.38 22.86 28.19 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.685 179.929 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.585 ' CD1' HD12 ' A' ' 18' ' ' LEU . 30.2 t80 -110.08 127.06 54.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.843 0.354 . . . . 0.0 110.704 179.845 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.575 ' HB3' HG23 ' A' ' 26' ' ' VAL . 4.9 t0 -68.09 110.35 3.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.888 -179.979 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.547 ' HA ' HD23 ' A' ' 27' ' ' LEU . 11.4 p-10 -61.71 -19.46 62.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.222 179.836 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.66 -20.91 66.09 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.273 179.987 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.575 HG23 ' HB3' ' A' ' 23' ' ' ASP . 21.8 t -82.1 -40.2 17.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.426 -179.752 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.609 HD13 ' CZ ' ' A' ' 14' ' ' PHE . 1.2 pp -56.6 -36.56 69.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.965 -179.777 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.732 ' O ' HD22 ' A' ' 32' ' ' LEU . 11.6 t30 -63.23 -16.2 59.47 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.408 -179.97 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.418 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 57.2 mt-10 -90.12 -35.27 15.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.837 0.351 . . . . 0.0 111.218 -179.716 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 1.051 HG23 HG21 ' A' ' 61' ' ' ILE . 11.8 p -90.5 -32.2 5.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.367 -0.379 . . . . 0.0 112.002 -179.589 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.926 HD12 HG13 ' A' ' 30' ' ' VAL . 1.7 mp -76.49 -48.86 25.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.578 -179.446 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.732 HD22 ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -56.96 -22.43 37.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.683 0.278 . . . . 0.0 111.189 -179.752 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.724 ' N ' HD23 ' A' ' 32' ' ' LEU . 93.5 m -82.68 -28.93 30.29 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.878 0.371 . . . . 0.0 110.808 179.66 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.725 HD21 HD21 ' A' ' 40' ' ' LEU . 12.6 mt -90.12 -23.04 21.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.731 -179.421 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -104.16 20.24 18.67 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -179.176 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.466 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 7.4 mtmt -118.37 -55.85 2.19 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.211 179.79 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.466 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 10.1 pttm 156.29 -20.54 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.035 179.665 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -61.86 111.27 4.2 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.072 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -68.64 163.86 35.35 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.412 2.075 . . . . 0.0 112.117 179.8 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.725 HD21 HD21 ' A' ' 34' ' ' LEU . 5.2 mt -86.44 123.42 31.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.064 179.977 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -61.6 157.26 48.74 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.947 -179.871 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.77 -30.56 49.89 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.616 2.21 . . . . 0.0 112.294 179.875 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.79 -19.47 59.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.01 179.822 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.439 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.1 m-85 -62.69 -16.52 57.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.217 179.983 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 67.44 52.06 0.82 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.923 0.392 . . . . 0.0 110.952 -179.862 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.6 p-10 -88.28 107.69 18.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.787 179.902 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.96 -168.29 3.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.855 -179.965 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -90.8 126.89 36.15 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.143 179.855 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.489 HD21 ' CD ' ' A' ' 58' ' ' GLU . 1.5 mp -64.48 169.01 5.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.895 179.93 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.42 167.75 10.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.09 179.948 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.27 -126.3 7.32 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.559 -179.94 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.03 -5.22 55.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.639 0.257 . . . . 0.0 111.37 179.965 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 6.0 m0 -97.65 29.31 3.39 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.89 0.376 . . . . 0.0 110.966 179.949 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.527 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -66.83 -56.2 14.9 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.407 -179.871 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 19.0 Cg_endo -59.2 -12.65 16.74 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.343 2.029 . . . . 0.0 112.572 -179.994 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.457 ' CD1' HD21 ' A' ' 79' ' ' LEU . 17.7 m-85 -93.71 170.12 9.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.841 0.353 . . . . 0.0 110.865 179.949 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.78 132.95 44.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.793 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.516 ' HG3' HG22 ' A' ' 68' ' ' VAL . 1.8 tt0 -104.76 170.01 8.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.971 -179.961 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.41 ' SG ' HD13 ' A' ' 40' ' ' LEU . 16.3 t -164.94 122.45 1.6 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.764 -179.981 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 10.4 m170 -93.02 84.22 4.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.068 -179.826 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 1.051 HG21 HG23 ' A' ' 30' ' ' VAL . 3.6 mp -64.82 -49.58 79.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.041 0.448 . . . . 0.0 110.811 179.714 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.617 ' HD2' HG22 ' A' ' 61' ' ' ILE . 0.1 OUTLIER -111.03 174.11 2.52 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.476 -179.851 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.412 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 12.9 Cg_exo -69.1 -5.82 16.74 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.617 2.211 . . . . 0.0 112.78 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -150.19 34.18 0.65 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.782 179.941 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.861 ' O ' HD23 ' A' ' 66' ' ' LEU . 88.5 t -133.7 142.68 40.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.94 -179.835 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.861 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.6 OUTLIER -145.97 98.81 3.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.876 179.97 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.739 HD13 ' HE1' ' A' ' 10' ' ' PHE . 1.0 OUTLIER -97.65 113.39 25.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.552 179.983 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.529 ' N ' HD12 ' A' ' 67' ' ' LEU . 60.9 t -85.24 138.07 19.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.255 -179.835 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 31.4 p90 -143.8 147.14 33.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.863 179.781 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.803 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.3 OUTLIER -103.28 157.36 17.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.871 -179.892 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.682 ' H ' HD23 ' A' ' 70' ' ' LEU . 21.6 t -107.81 109.92 30.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.25 -179.929 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.66 165.97 19.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.623 179.8 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -41.88 -32.73 0.44 Allowed 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.378 -179.811 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -163.43 29.9 0.09 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.805 179.757 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -150.0 162.02 41.19 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.7 -179.864 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.2 tp -117.13 137.23 52.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.93 0.395 . . . . 0.0 110.66 179.706 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.819 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.4 pp -128.16 137.75 56.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.245 -179.849 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.547 HD11 HD11 ' A' ' 4' ' ' LEU . 80.0 mt -84.24 119.93 25.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.738 179.788 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.497 HD13 HG12 ' A' ' 68' ' ' VAL . 0.2 OUTLIER -78.32 -68.86 0.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.901 -179.925 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.466 ' HD3' ' HB3' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -163.04 170.26 18.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.917 0.389 . . . . 0.0 111.355 179.826 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.755 HD21 HG13 ' A' ' 65' ' ' VAL . 3.4 tm? -126.91 134.19 50.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.662 179.96 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.565 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -160.39 -168.83 22.87 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.554 179.985 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.1 m -123.85 178.12 5.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.914 0.388 . . . . 0.0 110.732 -179.93 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -60.7 -29.3 69.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.001 -179.857 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.1 t -85.62 -30.43 23.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.035 -179.882 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.53 -71.68 0.4 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.898 -179.827 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.44 HD13 ' HB2' ' A' ' 66' ' ' LEU . 1.0 OUTLIER -63.4 -33.36 75.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.867 179.999 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.811 -179.96 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.2 mt . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.764 0.316 . . . . 0.0 110.904 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.83 165.61 3.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.818 179.969 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.6 tt -133.95 153.8 51.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.996 -179.919 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.765 ' HB2' HG22 ' A' ' 77' ' ' ILE . 7.0 t30 -138.19 -178.11 5.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.806 -179.993 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.612 HD23 HD12 ' A' ' 78' ' ' LEU . 15.4 mt -146.14 133.37 20.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.976 -179.956 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.82 164.34 11.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.796 179.968 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.4 -31.73 72.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.93 -179.96 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.6 p -70.29 -37.31 74.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.92 179.988 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -59.2 -49.74 76.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.894 -179.948 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -64.03 -44.36 92.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.916 -179.995 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.0 mmtt -74.37 -7.67 53.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.526 179.968 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.28 -31.76 16.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.767 0.317 . . . . 0.0 110.962 -179.913 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.753 ' HE2' HD13 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -90.21 -54.9 3.82 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.344 179.944 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -49.46 -32.37 11.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.769 179.474 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.57 -22.35 26.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.86 179.62 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.417 ' O ' ' HB3' ' A' ' 22' ' ' PHE . 2.6 mt -83.77 -49.54 8.99 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 120.943 0.401 . . . . 0.0 110.264 179.682 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.803 HD13 ' HD1' ' A' ' 22' ' ' PHE . 4.3 mm? -47.26 -40.51 16.74 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.398 179.957 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.5 mt -89.54 -0.49 57.54 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.899 -179.405 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -98.52 33.49 2.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.804 0.335 . . . . 0.0 110.782 -179.887 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.66 23.53 53.04 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.331 -179.924 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.803 ' HD1' HD13 ' A' ' 18' ' ' LEU . 26.4 t80 -107.1 115.84 30.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.809 0.338 . . . . 0.0 110.675 -179.868 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.413 ' O ' ' CD1' ' A' ' 22' ' ' PHE . 5.9 t70 -55.1 146.25 18.85 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.193 -179.742 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.522 ' HA ' HD23 ' A' ' 27' ' ' LEU . 3.3 p30 -96.52 -29.22 14.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.048 -179.988 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.1 m -57.62 -40.61 79.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.112 -179.861 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.404 HG12 ' HB3' ' A' ' 23' ' ' ASP . 12.2 p -74.62 -26.85 20.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.332 -179.999 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.753 HD13 ' HE2' ' A' ' 14' ' ' PHE . 0.3 OUTLIER -59.71 -39.98 86.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.829 0.347 . . . . 0.0 110.901 -179.957 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.472 ' O ' ' HB3' ' A' ' 32' ' ' LEU . 32.1 t-20 -50.27 -57.62 7.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.025 -179.759 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.566 ' HA ' HD22 ' A' ' 32' ' ' LEU . 28.8 mt-10 -51.77 -19.83 1.85 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.744 179.952 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.457 HG22 ' HG3' ' A' ' 62' ' ' LYS . 76.6 t -88.94 -74.36 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.836 0.351 . . . . 0.0 111.746 -179.452 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.7 mp -50.77 -45.39 27.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.15 -0.477 . . . . 0.0 112.011 -178.982 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.891 HD23 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -57.05 -34.61 68.41 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 121.001 -0.28 . . . . 0.0 111.061 -179.498 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.891 ' N ' HD23 ' A' ' 32' ' ' LEU . 90.2 m -68.68 -27.11 65.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.796 0.331 . . . . 0.0 110.875 179.88 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 46.7 mt -90.06 -25.73 20.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.414 -179.719 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 20.4 mtp180 -104.17 20.12 18.9 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.278 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.507 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -115.62 -55.85 2.4 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.168 179.886 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.507 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 151.15 -20.43 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.996 0.518 . . . . 0.0 110.882 179.74 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.39 120.6 41.44 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.085 -179.638 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -72.49 -179.34 4.0 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.342 2.028 . . . . 0.0 112.135 179.882 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -123.2 129.28 51.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.84 179.958 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.414 ' HB2' ' CE1' ' A' ' 44' ' ' PHE . 1.9 m-20 -57.41 159.26 9.12 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.115 -179.887 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.75 -10.06 27.0 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.552 2.168 . . . . 0.0 112.471 -179.98 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.33 9.47 23.17 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.339 179.857 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.414 ' CE1' ' HB2' ' A' ' 41' ' ' ASP . 4.1 m-85 -89.43 8.42 30.94 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.292 179.864 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.426 ' HB2' ' CD2' ' A' ' 60' ' ' HIS . 1.2 mp0 60.31 40.0 18.2 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.824 0.345 . . . . 0.0 110.9 179.882 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -82.06 73.08 9.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.844 179.963 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -129.49 172.35 11.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.857 179.947 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -81.62 133.7 35.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.071 -179.946 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.627 HD11 ' HG3' ' A' ' 58' ' ' GLU . 15.4 mt -82.37 176.14 9.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.857 -179.993 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.7 mtpt -114.29 175.66 5.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.924 179.968 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.38 -128.78 13.71 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.5 -179.929 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.1 mmtt -67.98 -26.39 65.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.591 0.234 . . . . 0.0 110.889 179.995 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 5.6 m-90 -97.59 39.38 1.21 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.832 0.349 . . . . 0.0 110.887 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.461 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -75.35 -51.04 3.45 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.205 179.971 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 71.9 Cg_endo -77.73 3.52 6.84 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.32 2.013 . . . . 0.0 112.671 -179.988 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.418 ' HB3' ' CG1' ' A' ' 68' ' ' VAL . 12.4 m-85 -114.21 169.31 9.12 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.796 0.331 . . . . 0.0 110.89 179.904 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.41 ' HG2' ' CZ ' ' A' ' 69' ' ' TYR . 1.0 OUTLIER -128.58 145.22 51.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.947 -179.987 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.627 ' HG3' HD11 ' A' ' 49' ' ' LEU . 1.4 tt0 -102.75 165.78 10.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.909 179.946 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -162.31 116.72 1.83 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.855 179.938 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.426 ' CD2' ' HB2' ' A' ' 45' ' ' GLN . 5.0 m170 -90.68 85.88 6.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.986 179.978 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.587 ' H ' HD12 ' A' ' 61' ' ' ILE . 4.3 mp -59.8 -29.17 42.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.021 -179.978 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.457 ' HG3' HG22 ' A' ' 30' ' ' VAL . 4.7 mtpt -142.61 168.34 13.61 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.77 -179.911 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.403 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 20.3 Cg_exo -65.43 -6.71 14.09 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.643 2.229 . . . . 0.0 112.743 -179.916 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -138.64 25.95 2.57 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.86 179.789 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.402 ' O ' HD23 ' A' ' 66' ' ' LEU . 67.5 t -140.78 140.83 32.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.218 179.945 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 1.082 HD12 HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -157.31 114.86 3.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.485 179.974 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.662 HD12 ' O ' ' A' ' 68' ' ' VAL . 0.2 OUTLIER -121.23 139.43 53.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.039 -179.881 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.662 ' O ' HD12 ' A' ' 67' ' ' LEU . 39.2 t -88.69 147.0 5.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.794 179.841 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.41 ' CZ ' ' HG2' ' A' ' 57' ' ' ARG . 9.0 p90 -148.99 161.08 42.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.115 -179.974 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.802 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.3 OUTLIER -116.06 156.69 25.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.828 179.958 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.659 ' H ' HD23 ' A' ' 70' ' ' LEU . 21.3 t -107.33 99.75 9.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.184 179.951 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.76 170.72 13.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.781 179.947 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -60.43 104.25 0.31 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.809 179.945 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 57.17 20.98 6.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.139 -179.843 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -149.55 138.51 21.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.639 -179.982 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.37 148.33 24.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.867 179.699 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.802 HD11 ' HB2' ' A' ' 70' ' ' LEU . 1.9 pp -139.32 130.8 34.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.331 -179.87 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.612 HD12 HD23 ' A' ' 6' ' ' LEU . 80.0 mt -74.96 148.21 40.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.511 179.677 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.38 -73.58 0.68 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.273 -179.698 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.02 161.52 42.18 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.989 0.423 . . . . 0.0 111.499 -179.8 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.581 ' C ' HD13 ' A' ' 81' ' ' LEU . 3.4 tm? -115.01 131.56 56.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.694 179.881 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.581 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -137.17 -177.75 15.32 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.451 179.931 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.7 m -150.72 178.14 9.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.879 0.371 . . . . 0.0 110.893 179.995 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.0 t-80 -64.04 -27.17 68.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.948 -179.998 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.7 m -87.41 -28.26 22.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.945 179.94 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -85.62 -74.82 0.39 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.015 -179.895 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 1.082 HD12 HD12 ' A' ' 66' ' ' LEU . 41.3 mt -62.08 -41.74 98.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.956 -179.909 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.887 179.982 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 40.1 mt . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.845 0.355 . . . . 0.0 110.885 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.34 149.17 22.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.884 179.915 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.408 HD11 HD11 ' A' ' 78' ' ' LEU . 0.6 OUTLIER -115.66 148.15 40.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.956 179.912 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.78 ' HB2' HG22 ' A' ' 77' ' ' ILE . 5.6 t30 -133.46 176.75 8.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.824 179.948 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 54.1 mt -148.98 112.8 5.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.928 179.933 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.3 mmtt -86.89 176.87 7.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.935 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.06 -33.57 68.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.845 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.4 t -67.23 -35.9 80.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.949 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.644 ' HE2' HD13 ' A' ' 67' ' ' LEU . 22.2 t80 -72.06 -31.15 65.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.877 179.933 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -68.99 -40.45 78.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.843 179.976 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.402 ' O ' ' CB ' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -85.73 -9.49 57.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.336 -179.999 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.65 ' O ' HD12 ' A' ' 17' ' ' LEU . 0.7 OUTLIER -90.36 -27.18 19.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.714 0.292 . . . . 0.0 111.008 179.915 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.512 ' CE1' HD21 ' A' ' 18' ' ' LEU . 7.4 t80 -91.23 -69.52 0.73 Allowed 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.334 179.704 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.528 ' HA ' HD12 ' A' ' 18' ' ' LEU . 21.1 t0 -49.19 -50.08 39.69 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.239 179.719 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.402 ' CB ' ' O ' ' A' ' 12' ' ' LYS . 1.5 tpmp? -68.08 -13.52 62.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.205 -179.982 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.65 HD12 ' O ' ' A' ' 13' ' ' ASP . 3.9 mt -90.27 -55.09 3.74 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-O 121.189 0.518 . . . . 0.0 110.013 179.503 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.528 HD12 ' HA ' ' A' ' 15' ' ' ASP . 0.5 OUTLIER -54.57 -25.89 28.99 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.379 179.868 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 74.9 mt -90.08 -35.15 15.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.941 179.954 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -62.56 -23.36 66.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.146 -179.968 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.99 42.62 0.16 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.47 -179.946 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -113.44 123.54 50.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.777 0.323 . . . . 0.0 110.724 179.908 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.649 ' HB3' HG23 ' A' ' 26' ' ' VAL . 2.7 t0 -56.38 103.27 0.1 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.897 179.944 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.462 ' CA ' HD23 ' A' ' 27' ' ' LEU . 5.1 p30 -54.93 -28.71 53.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.026 -179.962 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.13 -27.05 52.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.095 -179.959 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.649 HG23 ' HB3' ' A' ' 23' ' ' ASP . 35.2 t -72.51 -35.74 52.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.261 -179.88 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.497 ' HB2' HD13 ' A' ' 31' ' ' ILE . 1.2 pp -58.54 -36.66 74.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.186 -179.625 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.848 ' O ' HD22 ' A' ' 32' ' ' LEU . 0.9 OUTLIER -58.42 -19.63 37.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.319 -179.798 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -90.06 -37.69 14.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.388 -179.624 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.833 HG13 HD12 ' A' ' 31' ' ' ILE . 14.8 p -90.31 -44.99 14.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 112.162 0.431 . . . . 0.0 112.162 -179.197 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.833 HD12 HG13 ' A' ' 30' ' ' VAL . 1.7 mp -62.25 -51.94 66.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.55 0.214 . . . . 0.0 111.408 -179.506 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.848 HD22 ' O ' ' A' ' 28' ' ' ASN . 0.4 OUTLIER -53.9 -37.24 63.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.716 0.293 . . . . 0.0 111.081 -179.576 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.722 ' H ' HD23 ' A' ' 32' ' ' LEU . 84.8 m -65.88 -37.65 86.71 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.866 0.365 . . . . 0.0 110.598 179.867 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.406 HD11 ' CD2' ' A' ' 67' ' ' LEU . 97.2 mt -72.82 -30.01 63.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.841 179.924 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.4 mtp180 -102.95 20.13 18.11 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.997 -179.983 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.441 ' O ' ' CG ' ' A' ' 37' ' ' LYS . 2.5 mmmt -116.85 19.38 14.43 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.369 -179.899 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.441 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 3.9 pttp 45.77 39.2 4.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.263 -179.957 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -108.07 111.91 61.78 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.731 -179.922 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -67.3 136.87 41.67 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.419 2.079 . . . . 0.0 112.257 179.961 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.479 HD13 ' SG ' ' A' ' 59' ' ' CYS . 27.0 mt -79.45 179.8 7.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.877 179.984 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -112.23 155.71 43.12 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.932 -179.988 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -67.17 -10.93 30.32 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 122.629 2.219 . . . . 0.0 112.537 179.92 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.96 7.23 25.14 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.417 179.937 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -93.47 14.95 17.08 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.585 0.231 . . . . 0.0 111.121 179.89 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 59.25 38.17 23.43 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.868 0.366 . . . . 0.0 110.972 179.89 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -93.55 112.72 24.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.927 179.945 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 24.8 p-80 -163.36 -175.74 4.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.899 -179.981 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.38 129.58 35.0 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.113 179.97 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.424 ' H ' HD12 ' A' ' 49' ' ' LEU . 4.4 mp -74.39 174.63 8.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.829 -179.929 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -102.63 163.58 12.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.895 -179.915 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.25 -137.51 18.51 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.602 -179.92 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.56 -5.07 48.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.649 0.261 . . . . 0.0 111.45 179.965 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 9.5 m0 -97.05 33.2 1.97 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.791 0.329 . . . . 0.0 111.096 -179.955 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.438 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 7.2 tttt -81.44 -51.05 0.89 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.962 179.957 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.448 ' O ' HD11 ' A' ' 70' ' ' LEU . 50.2 Cg_exo -55.46 -18.12 18.59 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.425 2.084 . . . . 0.0 112.367 179.749 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -102.1 177.86 4.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.904 0.383 . . . . 0.0 111.012 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.545 ' O ' HG13 ' A' ' 68' ' ' VAL . 5.7 tpp180 -135.96 139.63 43.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.936 179.984 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.404 ' HB2' HD11 ' A' ' 49' ' ' LEU . 4.6 tt0 -95.95 158.68 15.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.815 179.955 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.479 ' SG ' HD13 ' A' ' 40' ' ' LEU . 2.6 t -160.94 113.41 1.93 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.866 -179.945 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.423 ' ND1' HD22 ' A' ' 66' ' ' LEU . 3.5 m-70 -97.2 89.46 4.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.981 179.928 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.648 HD11 HD23 ' A' ' 67' ' ' LEU . 4.4 mp -55.08 -27.49 19.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.013 179.762 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.441 ' HB2' ' CD ' ' A' ' 63' ' ' PRO . 0.0 OUTLIER -154.77 170.96 7.76 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.551 179.971 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.441 ' CD ' ' HB2' ' A' ' 62' ' ' LYS . 17.0 Cg_exo -67.0 -0.06 4.33 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.689 2.259 . . . . 0.0 113.164 -179.702 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -134.86 25.21 3.64 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.664 0.268 . . . . 0.0 111.157 179.89 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.616 HG13 HD21 ' A' ' 81' ' ' LEU . 58.4 t -155.63 143.63 12.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.004 0.431 . . . . 0.0 111.309 179.913 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.825 HD12 HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -159.13 100.43 1.54 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.693 179.794 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.648 HD23 HD11 ' A' ' 61' ' ' ILE . 0.3 OUTLIER -105.84 151.51 24.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.893 -179.858 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.545 HG13 ' O ' ' A' ' 57' ' ' ARG . 59.0 t -100.53 139.95 20.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.13 -179.914 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.672 ' CD1' HD11 ' A' ' 76' ' ' LEU . 16.9 p90 -145.66 158.48 43.84 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.924 179.912 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.623 ' HB2' HD11 ' A' ' 77' ' ' ILE . 6.7 tp -114.08 157.77 22.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.857 179.866 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -113.75 105.34 18.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.206 -179.919 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 10.6 tptt -76.09 165.73 24.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.666 179.815 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -44.53 -31.87 1.24 Allowed 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.363 -179.942 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -160.4 28.79 0.16 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.787 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -148.55 163.51 36.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.654 179.985 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.672 HD11 ' CD1' ' A' ' 69' ' ' TYR . 10.0 tp -122.52 130.9 53.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.673 179.658 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.78 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.1 pp -122.8 133.35 69.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.349 -179.665 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.408 HD11 HD11 ' A' ' 4' ' ' LEU . 85.7 mt -82.25 126.61 32.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.637 179.648 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.38 -66.21 0.92 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.055 -179.783 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.52 ' HE ' HG21 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -162.13 165.71 26.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.989 0.423 . . . . 0.0 111.478 -179.945 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.702 HD22 ' N ' ' A' ' 82' ' ' GLY . 1.7 tm? -124.7 135.65 53.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.656 -179.913 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.702 ' N ' HD22 ' A' ' 81' ' ' LEU . . . -162.3 -172.19 29.42 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.687 179.932 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.92 -167.97 1.96 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.837 0.351 . . . . 0.0 110.878 -179.915 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -73.54 -27.53 61.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.022 -179.964 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.5 t -86.56 -22.69 26.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.221 -180.0 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -87.28 -69.13 0.7 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.853 0.359 . . . . 0.0 111.041 -179.987 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.825 HD12 HD12 ' A' ' 66' ' ' LEU . 25.4 mt -59.83 -40.68 89.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.025 -179.959 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.892 179.971 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 62.1 mt . . . . . 0 N--CA 1.457 -0.107 0 CA-C-O 120.736 0.303 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.69 156.11 17.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.918 179.997 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.442 HD11 HD11 ' A' ' 78' ' ' LEU . 2.2 tt -120.28 143.75 48.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.842 179.939 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.457 ' HB2' HG22 ' A' ' 77' ' ' ILE . 1.5 t-20 -126.7 178.5 5.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.985 -179.929 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 41.0 mt -144.18 123.12 12.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.899 179.965 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.3 mmmt -97.05 174.42 6.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.978 -179.924 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.06 -46.53 80.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.802 179.911 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 t -58.06 -24.11 57.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.934 179.831 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.742 ' HE1' HD13 ' A' ' 67' ' ' LEU . 32.9 t80 -84.23 -26.59 28.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.034 179.976 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -69.51 -28.03 65.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.204 -179.782 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.477 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -90.04 -7.47 53.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.781 -179.745 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.502 ' OD2' ' HA ' ' A' ' 10' ' ' PHE . 18.4 p30 -90.6 -15.97 29.57 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.894 0.378 . . . . 0.0 111.57 -179.811 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.649 ' O ' HD13 ' A' ' 18' ' ' LEU . 8.8 t80 -90.86 -60.21 1.97 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.228 -178.994 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.789 ' HA ' HD22 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -91.6 -41.0 11.01 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.374 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.477 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 2.0 mptm? -69.99 -40.08 75.53 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -178.839 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.407 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 0.9 OUTLIER -59.39 -29.39 67.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.929 0.395 . . . . 0.0 110.214 179.698 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.789 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.3 OUTLIER -62.47 -24.1 67.27 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.116 179.856 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.2 15.11 10.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.393 -179.885 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -123.87 45.0 2.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.818 0.342 . . . . 0.0 110.885 179.873 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 71.21 28.89 69.32 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.328 -179.946 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.468 ' CD1' HD12 ' A' ' 18' ' ' LEU . 8.9 t80 -113.18 140.58 47.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.854 0.359 . . . . 0.0 110.783 -179.93 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.419 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 4.3 t0 -97.49 117.9 32.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.902 179.987 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.821 ' HA ' HD23 ' A' ' 27' ' ' LEU . 2.9 p30 -59.73 -28.73 67.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.237 -179.923 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 25.1 p -54.96 -23.31 18.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.542 -179.83 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.6 t -87.38 -42.71 15.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.765 0.317 . . . . 0.0 111.384 -179.726 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.821 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.4 OUTLIER -59.25 -32.27 69.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.01 -179.833 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -53.51 -31.2 45.07 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.875 -179.986 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -81.63 -23.35 37.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.824 179.696 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 96.2 t -78.08 -73.1 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.023 -179.973 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.6 mp -47.45 -33.57 3.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.865 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.844 HD23 ' N ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -58.86 -55.18 38.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.565 179.72 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.844 ' N ' HD23 ' A' ' 32' ' ' LEU . 99.2 m -58.53 -34.76 71.35 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.945 -179.943 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.0 mt -66.75 -46.79 74.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.841 -179.978 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -96.04 20.15 10.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.084 179.994 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.8 mmtt -97.37 12.67 32.33 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.398 -179.905 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.4 mtmt 61.94 27.42 16.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.778 0.323 . . . . 0.0 110.832 179.964 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.25 123.72 29.17 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.863 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -74.31 150.22 41.44 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.361 2.04 . . . . 0.0 112.379 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.416 HD13 ' SG ' ' A' ' 59' ' ' CYS . 4.8 mt -88.27 128.05 35.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.818 179.996 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.26 158.22 88.07 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.066 -179.953 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.66 -10.33 28.36 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.526 2.15 . . . . 0.0 112.455 179.857 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.1 5.86 27.97 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.316 179.817 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -93.69 17.28 12.12 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-O 120.662 0.267 . . . . 0.0 111.183 179.872 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.421 ' HB2' ' CG ' ' A' ' 60' ' ' HIS . 45.0 mm-40 63.98 30.29 14.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.087 179.882 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -88.68 87.92 7.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.906 -179.962 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 17.8 p-80 -143.45 176.37 9.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.873 179.992 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.26 140.29 46.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.101 -179.959 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.572 HD21 ' OE1' ' A' ' 58' ' ' GLU . 1.4 mt -89.7 174.17 7.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.946 179.884 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.0 mtpm? -109.34 164.6 12.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.946 179.981 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.76 -140.91 22.18 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.513 179.989 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.2 tmtt? -74.02 -8.53 56.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.598 0.237 . . . . 0.0 111.352 -179.974 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 19.7 m-90 -96.51 26.39 4.45 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.762 0.315 . . . . 0.0 111.197 -179.942 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.461 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.2 OUTLIER -74.54 -49.52 4.92 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.002 179.911 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.461 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 43.6 Cg_exo -56.45 -17.65 22.37 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.4 2.067 . . . . 0.0 112.437 179.779 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -110.27 174.45 5.86 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.004 -179.87 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.458 ' O ' HG13 ' A' ' 68' ' ' VAL . 41.5 ttm180 -131.13 154.52 48.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.813 179.923 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.572 ' OE1' HD21 ' A' ' 49' ' ' LEU . 3.4 tt0 -105.03 170.14 8.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.931 -179.928 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.416 ' SG ' HD13 ' A' ' 40' ' ' LEU . 3.5 t -168.5 116.88 0.7 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.738 179.997 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.609 ' CD2' HD22 ' A' ' 66' ' ' LEU . 11.1 m170 -95.32 89.08 5.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.993 -179.938 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.582 ' H ' HD12 ' A' ' 61' ' ' ILE . 4.2 mp -66.25 -29.88 48.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.903 179.778 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 16.8 mttt -136.68 171.79 8.08 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.78 179.966 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -68.18 -3.12 10.14 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.663 2.242 . . . . 0.0 112.906 -179.984 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -147.23 30.39 0.94 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.785 179.82 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.814 ' O ' HD23 ' A' ' 66' ' ' LEU . 58.8 t -138.37 144.13 31.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.277 179.88 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.814 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.6 OUTLIER -149.8 108.44 3.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.771 -179.975 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.742 HD13 ' HE1' ' A' ' 10' ' ' PHE . 0.1 OUTLIER -108.69 133.54 52.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.001 0.429 . . . . 0.0 110.989 -179.957 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.49 ' N ' HD12 ' A' ' 67' ' ' LEU . 97.4 t -94.7 140.96 15.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.724 179.751 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.479 ' CD2' HD21 ' A' ' 76' ' ' LEU . 3.1 p90 -146.06 168.48 20.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.905 179.945 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.769 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.3 OUTLIER -125.64 -178.01 4.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.95 -179.822 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.7 t -128.27 115.81 39.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.075 179.871 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -99.51 -178.42 3.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.862 179.99 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -66.28 103.54 1.03 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.854 -179.898 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 56.82 22.73 7.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.14 179.984 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -155.28 136.34 13.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.819 -179.975 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.479 HD21 ' CD2' ' A' ' 69' ' ' TYR . 4.5 tp -93.93 154.4 17.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.878 -179.992 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.769 HD11 ' HB2' ' A' ' 70' ' ' LEU . 1.9 pp -138.27 132.92 42.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.266 -179.94 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.54 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 55.4 mt -81.33 142.06 33.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.566 179.686 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.413 HD12 ' HD3' ' A' ' 80' ' ' ARG . 0.2 OUTLIER -99.71 -71.12 0.71 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.279 -179.63 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.413 ' HD3' HD12 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -157.36 161.08 39.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.011 0.434 . . . . 0.0 111.498 -179.587 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.541 ' C ' HD13 ' A' ' 81' ' ' LEU . 3.2 tm? -112.51 125.33 54.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.566 179.94 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.522 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -136.27 -161.91 9.31 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.66 -179.918 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.4 p -150.57 -177.75 6.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.904 0.383 . . . . 0.0 110.846 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -66.77 -27.98 68.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.995 179.991 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -87.36 -24.97 24.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.193 -179.96 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.15 -73.63 0.43 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.897 -179.888 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.63 HD12 ' HB2' ' A' ' 66' ' ' LEU . 23.3 mt -61.32 -41.08 96.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.93 -179.96 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.213 -0.898 . . . . 0.0 110.868 -179.952 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 N--CA 1.458 -0.034 0 CA-C-O 120.915 0.388 . . . . 0.0 110.84 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.79 155.91 12.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.836 179.98 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.79 147.46 46.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.993 -179.936 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.744 ' HB2' HG22 ' A' ' 77' ' ' ILE . 1.2 t-20 -133.33 177.62 7.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.849 179.91 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.8 mp -143.48 132.55 22.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.969 179.968 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.429 ' HE2' HD13 ' A' ' 77' ' ' ILE . 30.1 mmtm -107.39 158.91 16.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.806 180.0 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.3 mttp -61.77 -32.67 72.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.765 179.955 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 88.8 p -63.57 -23.31 67.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.153 179.925 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.59 ' HE1' HD13 ' A' ' 67' ' ' LEU . 53.8 t80 -78.14 -32.07 50.16 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.085 -179.811 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -70.06 -47.88 60.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.128 -179.905 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -75.21 -6.49 49.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.556 -179.959 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.538 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -90.83 -22.6 20.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.976 179.937 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.666 ' CZ ' HD22 ' A' ' 27' ' ' LEU . 43.6 t80 -90.81 -70.85 0.66 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.552 -179.74 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -49.72 -35.81 23.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.212 -179.871 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.481 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 4.5 tppt? -76.57 -20.89 56.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.981 179.88 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.664 HD11 ' OE1' ' A' ' 86' ' ' GLU . 1.6 mt -89.61 -52.21 5.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.951 0.405 . . . . 0.0 110.151 179.187 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.631 HD13 ' HD2' ' A' ' 22' ' ' PHE . 4.3 mm? -49.2 -32.43 10.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.536 -179.771 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.55 ' C ' HD12 ' A' ' 19' ' ' LEU . 4.4 pp -89.65 -8.22 52.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.708 -179.629 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -96.6 40.11 1.14 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.846 0.355 . . . . 0.0 110.846 -179.954 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 70.01 27.6 72.82 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.495 -179.936 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.631 ' HD2' HD13 ' A' ' 18' ' ' LEU . 67.6 t80 -95.35 128.14 41.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.827 0.346 . . . . 0.0 110.81 -179.95 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.405 ' HB3' HG23 ' A' ' 26' ' ' VAL . 0.7 OUTLIER -56.98 119.6 6.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.915 -179.97 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.542 ' HA ' HD23 ' A' ' 27' ' ' LEU . 9.0 p-10 -82.59 -34.84 27.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.157 -179.796 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.68 -22.62 47.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.257 -179.929 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.405 HG23 ' HB3' ' A' ' 23' ' ' ASP . 21.3 t -82.48 -35.06 12.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.392 -179.871 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.666 HD22 ' CZ ' ' A' ' 14' ' ' PHE . 0.8 OUTLIER -56.98 -36.45 70.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.107 -179.69 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.404 ' N ' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -62.77 -23.36 67.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.269 -179.798 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -80.04 -33.82 38.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.138 -179.814 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.723 HG13 HD12 ' A' ' 31' ' ' ILE . 11.7 p -89.96 -43.3 14.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.262 -179.879 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.723 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -64.75 -24.7 36.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.871 179.853 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.706 HD23 ' N ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -70.84 -46.85 61.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.15 -179.844 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.706 ' N ' HD23 ' A' ' 32' ' ' LEU . 55.8 m -62.81 -25.98 68.51 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.42 -179.473 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.0 mt -90.04 -35.72 15.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.73 0.3 . . . . 0.0 111.544 -179.478 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.17 20.23 7.14 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.335 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.472 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 3.2 mttm -118.43 -55.96 2.18 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.054 179.724 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.472 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 2.3 pttt 154.65 -20.41 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.0 179.565 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.66 ' HB3' HG23 ' A' ' 33' ' ' THR . 0.0 OUTLIER -65.31 120.72 70.02 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.163 -179.627 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.51 -178.74 4.7 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.476 2.118 . . . . 0.0 112.289 179.832 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.62 HD13 ' SG ' ' A' ' 59' ' ' CYS . 59.3 mt -92.31 108.66 20.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.929 179.843 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -58.74 161.6 8.16 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.98 -179.927 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -67.14 -33.25 31.93 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.461 2.107 . . . . 0.0 112.189 179.915 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -58.9 -21.07 56.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.106 179.854 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.432 ' CE2' ' HA ' ' A' ' 61' ' ' ILE . 3.5 m-85 -57.42 -21.78 38.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.136 179.961 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 64.44 66.57 0.6 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.988 0.423 . . . . 0.0 110.963 179.999 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -93.29 106.17 18.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.861 179.911 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 42.1 m80 -124.2 175.5 7.0 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.929 179.972 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -99.31 114.55 27.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.132 -179.967 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.657 HD11 ' HG3' ' A' ' 58' ' ' GLU . 3.3 mt -61.56 159.13 13.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.837 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.66 165.74 11.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.107 -179.928 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 58.39 108.21 0.01 OUTLIER Glycine 0 CA--C 1.507 -0.429 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.809 179.754 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.4 mptt 69.14 -46.15 0.56 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.628 0.252 . . . . 0.0 111.161 179.815 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 22.6 m95 -97.03 32.14 2.22 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.994 -179.894 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.434 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.2 OUTLIER -69.3 -51.86 16.47 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.087 179.891 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.434 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 98.9 Cg_endo -80.21 46.24 2.19 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.437 2.091 . . . . 0.0 112.522 179.933 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -156.52 175.66 13.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.852 0.358 . . . . 0.0 110.88 179.849 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.655 ' O ' HG13 ' A' ' 68' ' ' VAL . 14.7 ttm105 -137.79 144.04 41.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.919 -179.942 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.657 ' HG3' HD11 ' A' ' 49' ' ' LEU . 1.1 tt0 -105.35 177.31 4.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.975 -179.895 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.62 ' SG ' HD13 ' A' ' 40' ' ' LEU . 0.5 OUTLIER -168.26 126.09 1.12 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.68 -179.992 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.467 ' CE1' HD22 ' A' ' 66' ' ' LEU . 2.6 m-70 -102.19 82.69 2.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.07 -179.734 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.713 HG21 HG23 ' A' ' 30' ' ' VAL . 4.4 mp -59.99 -26.94 37.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.771 179.662 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.426 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 23.5 mtpp -139.82 169.25 12.51 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.566 179.927 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.426 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 12.2 Cg_exo -70.04 -0.19 6.78 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.802 2.335 . . . . 0.0 112.983 -179.86 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -143.33 27.61 1.55 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.875 179.877 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.83 ' O ' HD23 ' A' ' 66' ' ' LEU . 38.9 t -139.51 152.06 22.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.938 0.399 . . . . 0.0 111.311 179.992 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.83 HD23 ' O ' ' A' ' 65' ' ' VAL . 1.0 OUTLIER -148.17 100.54 3.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.552 179.804 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.775 HD12 ' N ' ' A' ' 68' ' ' VAL . 4.2 tp -97.48 131.32 44.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.059 -179.679 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.775 ' N ' HD12 ' A' ' 67' ' ' LEU . 57.1 t -106.14 136.75 39.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.891 179.793 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.612 ' CE1' HD11 ' A' ' 76' ' ' LEU . 45.3 p90 -153.55 164.04 38.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.136 -179.921 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.736 ' HB2' HD11 ' A' ' 77' ' ' ILE . 1.4 tp -106.39 174.46 5.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.864 179.916 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.4 t -123.86 123.23 66.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.26 -179.957 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 3.7 tptp -100.15 160.97 13.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.743 179.919 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -44.27 -49.46 9.35 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.54 -179.81 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -137.89 28.3 2.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.919 179.927 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 50.6 mp0 -156.88 170.0 23.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.824 179.96 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.612 HD11 ' CE1' ' A' ' 69' ' ' TYR . 0.7 OUTLIER -129.88 141.15 50.85 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.682 179.803 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.744 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.3 pp -128.95 131.55 68.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.396 -179.724 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 72.5 mt -73.43 158.44 34.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.599 179.77 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.84 -78.33 0.58 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.045 -179.885 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.72 167.06 29.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.013 0.435 . . . . 0.0 111.253 -179.909 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.868 HD13 ' N ' ' A' ' 82' ' ' GLY . 1.5 tm? -114.19 137.72 51.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.696 179.849 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.868 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -141.26 -176.32 15.52 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.675 -179.775 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -140.88 -176.15 4.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.812 0.339 . . . . 0.0 110.895 179.985 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -67.75 -27.78 67.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.167 -179.949 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.2 m -90.02 -27.57 19.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.099 -179.97 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.664 ' OE1' HD11 ' A' ' 17' ' ' LEU . 1.1 mt-10 -80.18 -75.11 0.27 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.842 0.353 . . . . 0.0 111.015 -179.798 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.552 HD12 ' HB2' ' A' ' 66' ' ' LEU . 29.6 mt -67.17 -38.43 85.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.023 -179.943 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.192 -0.908 . . . . 0.0 111.027 179.92 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 10.3 mt . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.809 0.337 . . . . 0.0 110.92 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -66.56 160.89 24.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.819 179.987 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.9 tt -128.64 144.96 51.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.905 179.781 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.755 ' HB2' HG22 ' A' ' 77' ' ' ILE . 0.9 OUTLIER -141.48 163.33 33.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.859 -179.925 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.6 mp -124.63 125.55 44.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.858 179.998 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.604 ' HE3' HD13 ' A' ' 77' ' ' ILE . 58.8 mmtt -92.12 168.86 11.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.942 -179.969 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -60.33 -32.23 71.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.782 -179.97 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.3 m -70.83 -47.49 59.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.821 179.936 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.479 ' HE1' HD13 ' A' ' 67' ' ' LEU . 31.3 t80 -63.86 -30.7 71.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.959 -179.833 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -63.23 -46.16 88.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.996 -179.916 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.5 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 7.4 pttt -87.08 -5.6 58.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.597 -179.955 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.428 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -90.77 -15.74 29.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.082 179.778 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.889 ' O ' HD13 ' A' ' 18' ' ' LEU . 21.1 t80 -90.82 -74.33 0.5 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.633 -179.474 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.681 ' HA ' HD22 ' A' ' 18' ' ' LEU . 1.1 m-20 -79.65 -32.93 41.65 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -178.899 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.5 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.4 OUTLIER -75.41 -16.57 60.34 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.213 -179.656 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.428 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 32.7 tp -90.14 -37.41 14.22 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.402 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.889 HD13 ' O ' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -50.9 -42.95 59.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.066 179.962 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.5 pp -89.28 0.72 56.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.691 -179.531 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -98.05 32.07 2.52 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.741 0.305 . . . . 0.0 110.85 -179.965 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.79 22.97 40.54 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.503 -179.843 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.579 ' CD1' HD12 ' A' ' 18' ' ' LEU . 34.2 t80 -106.99 141.71 37.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.803 0.335 . . . . 0.0 110.769 179.834 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.889 ' O ' HG12 ' A' ' 26' ' ' VAL . 16.0 t70 -78.89 105.58 10.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.829 179.954 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.594 ' HA ' HD23 ' A' ' 27' ' ' LEU . 27.3 p30 -64.92 -14.26 59.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.455 -179.954 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.1 t -75.84 -20.99 57.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.606 0.241 . . . . 0.0 111.47 -179.866 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.889 HG12 ' O ' ' A' ' 23' ' ' ASP . 14.3 p -88.8 -27.14 5.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.71 0.291 . . . . 0.0 111.614 -179.633 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.609 HD13 ' HE1' ' A' ' 14' ' ' PHE . 1.5 pp -59.11 -37.92 78.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.84 0.352 . . . . 0.0 110.956 -179.855 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -56.89 -24.96 55.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.192 -179.842 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -78.73 -44.73 22.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.152 -179.964 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.532 HG13 HD12 ' A' ' 31' ' ' ILE . 11.5 p -80.58 -48.96 19.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.313 -179.857 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.532 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -54.0 -34.56 26.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 121.08 0.467 . . . . 0.0 110.228 179.45 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.817 HD23 ' N ' ' A' ' 33' ' ' THR . 0.9 OUTLIER -52.08 -61.34 2.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.317 179.471 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.817 ' N ' HD23 ' A' ' 32' ' ' LEU . 39.1 m -54.23 -26.81 30.64 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.564 -179.867 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 32.8 mt -70.44 -49.51 47.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.758 0.313 . . . . 0.0 111.149 -179.766 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.1 mtm180 -77.35 -55.89 5.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.99 0.424 . . . . 0.0 110.806 -179.802 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.736 ' HE2' HD21 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -64.12 -16.7 62.38 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.599 -179.967 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.553 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 0.2 OUTLIER 53.35 73.06 0.39 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.332 179.807 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.672 ' HB3' HG23 ' A' ' 33' ' ' THR . 20.4 tt0 -84.11 139.09 39.42 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.138 178.781 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -58.56 105.0 0.2 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.451 2.101 . . . . 0.0 112.034 179.894 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 50.1 mt -62.48 178.78 0.38 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.013 -179.777 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -140.14 163.52 43.52 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.779 -179.985 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -64.24 -27.91 64.19 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.602 2.202 . . . . 0.0 112.291 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.25 -17.92 64.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.247 179.942 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.426 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.6 m-85 -69.49 -10.7 59.17 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.48 -179.988 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 61.89 36.89 15.63 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.893 0.378 . . . . 0.0 110.902 -179.959 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.2 p-10 -75.77 84.42 2.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.879 179.789 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 -140.48 -177.61 5.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.061 -179.921 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.9 157.23 33.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.162 -179.945 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.58 HD11 ' HG3' ' A' ' 58' ' ' GLU . 53.9 mt -105.3 -178.35 3.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.913 180.0 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -118.08 175.17 5.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.91 -179.879 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 71.81 -138.19 26.73 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.546 -179.954 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.18 -28.19 69.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.694 0.283 . . . . 0.0 111.0 179.98 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 8.1 m95 -97.32 39.26 1.2 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.726 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.462 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 3.1 tmtp? -69.51 -51.38 16.65 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.314 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.462 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 81.9 Cg_endo -78.67 6.6 4.75 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.449 2.1 . . . . 0.0 112.878 -179.787 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -105.39 173.38 6.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.842 0.354 . . . . 0.0 110.87 179.93 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.611 ' O ' HG13 ' A' ' 68' ' ' VAL . 23.1 ttm180 -131.74 142.9 49.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.979 -179.967 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.58 ' HG3' HD11 ' A' ' 49' ' ' LEU . 1.2 tt0 -110.75 171.67 7.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.985 -179.914 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 8.3 t -160.78 118.47 2.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.719 179.882 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.591 ' CE1' HD22 ' A' ' 66' ' ' LEU . 3.8 m-70 -94.4 78.7 3.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.977 -179.858 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.524 ' CB ' HG23 ' A' ' 30' ' ' VAL . 3.7 mp -57.06 -27.12 26.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.072 179.76 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.558 ' NZ ' HG22 ' A' ' 26' ' ' VAL . 10.5 mtmm -139.37 169.26 12.71 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.708 179.991 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.402 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 13.7 Cg_exo -69.19 -3.32 11.4 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.78 2.32 . . . . 0.0 112.875 -179.834 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -141.29 26.02 2.02 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.922 179.881 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.845 ' O ' HD23 ' A' ' 66' ' ' LEU . 56.9 t -136.64 147.11 27.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.173 179.97 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.845 HD23 ' O ' ' A' ' 65' ' ' VAL . 2.4 mt -144.31 97.98 3.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.647 179.846 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.743 HD12 ' N ' ' A' ' 68' ' ' VAL . 4.2 tp -94.15 127.81 40.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.979 -179.865 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.743 ' N ' HD12 ' A' ' 67' ' ' LEU . 46.6 t -105.08 136.35 39.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.727 179.769 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -147.89 153.67 39.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.054 179.964 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.773 ' HB2' HD11 ' A' ' 77' ' ' ILE . 3.6 tp -99.18 173.13 6.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.893 -179.995 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.424 ' HA ' HD12 ' A' ' 76' ' ' LEU . 21.5 t -123.68 102.94 12.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.181 -179.966 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 13.5 tptp -73.48 162.32 29.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.758 179.962 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -44.95 -43.33 8.92 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.376 -179.86 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -145.4 29.72 1.14 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.819 179.902 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.3 mp0 -157.39 167.99 28.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.802 -179.885 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.424 HD12 ' HA ' ' A' ' 71' ' ' VAL . 10.8 tp -120.19 139.13 53.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.797 179.902 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.773 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.3 pp -128.83 131.6 68.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.339 -179.806 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 71.9 mt -73.68 137.14 43.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.704 179.742 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.09 -72.01 0.63 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.021 -179.767 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.447 ' NH2' HG11 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -161.16 170.48 20.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.849 0.357 . . . . 0.0 111.32 -179.949 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.617 HD13 ' N ' ' A' ' 82' ' ' GLY . 1.9 tm? -122.77 125.33 45.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.93 -179.943 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.617 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -135.43 -162.11 9.56 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.464 179.93 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -148.08 155.26 41.27 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.125 0.488 . . . . 0.0 110.909 -179.994 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.537 ' HA ' HD11 ' A' ' 66' ' ' LEU . 1.0 OUTLIER -49.07 -28.14 3.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.359 -179.886 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 12.1 t -90.09 -22.13 21.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.152 179.823 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -82.71 -73.56 0.39 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.263 -179.83 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.696 ' CD1' HD12 ' A' ' 66' ' ' LEU . 1.1 mp -51.36 -33.8 31.22 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.289 -179.724 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.27 -0.871 . . . . 0.0 110.873 -179.994 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.542 HD13 ' CB ' ' A' ' 76' ' ' LEU . 1.4 pp . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.765 0.317 . . . . 0.0 110.873 . . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.31 150.89 24.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.913 -179.974 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.3 tp -125.16 138.33 54.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.8 179.923 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.736 ' HB2' HG22 ' A' ' 77' ' ' ILE . 1.1 t-20 -118.58 169.58 9.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.835 -179.954 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 33.3 mt -132.21 112.68 12.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.881 -179.961 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.31 161.68 18.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.908 -179.989 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.7 tptt -61.38 -34.46 75.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.825 -179.985 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 39.3 m -69.69 -32.6 71.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.777 179.958 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -73.52 -38.48 65.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.856 -179.965 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -63.34 -37.58 87.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.802 -179.993 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.577 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 1.8 mttp -83.9 -25.56 30.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.234 0.54 . . . . 0.0 111.055 -179.999 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.466 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 1.2 m-20 -90.9 -9.42 46.31 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.067 179.805 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.829 ' CE1' HD13 ' A' ' 27' ' ' LEU . 47.5 t80 -91.26 -68.02 0.82 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.14 -179.604 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -91.05 -34.59 15.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.806 -179.331 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.577 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -78.68 -15.21 58.75 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.167 -179.48 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.466 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 31.6 tp -80.55 -35.18 34.74 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.957 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.704 HD13 ' CB ' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -64.01 -53.37 51.1 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.914 179.71 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.3 mt -60.08 -36.96 78.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.928 179.984 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -24.9 61.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.948 179.901 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.97 37.88 0.24 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.639 179.915 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.4 ' CB ' ' HG ' ' A' ' 17' ' ' LEU . 76.0 t80 -121.63 163.59 18.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.802 0.334 . . . . 0.0 110.866 -179.987 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -76.13 125.45 29.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.101 -179.854 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.704 ' CB ' HD13 ' A' ' 18' ' ' LEU . 7.6 p-10 -93.26 -15.82 25.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.191 179.741 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.1 m -78.83 -34.69 45.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.787 0.327 . . . . 0.0 111.047 -179.678 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 11.7 p -66.81 -27.38 39.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.389 -179.87 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.829 HD13 ' CE1' ' A' ' 14' ' ' PHE . 1.3 pp -64.78 -37.97 89.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.106 -179.803 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.801 ' O ' HD22 ' A' ' 32' ' ' LEU . 7.3 t-20 -61.52 -26.57 68.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.061 -179.988 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.412 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 2.2 mm-40 -74.81 -33.99 62.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.132 -179.869 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 1.11 HG23 HG21 ' A' ' 61' ' ' ILE . 11.7 p -90.65 -41.08 13.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.923 -179.645 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.699 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -64.12 -54.91 25.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.718 -179.301 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.801 HD22 ' O ' ' A' ' 28' ' ' ASN . 0.8 OUTLIER -50.38 -22.53 1.89 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 -179.073 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.562 ' N ' HD23 ' A' ' 32' ' ' LEU . 38.9 m -90.29 -42.57 10.9 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 120.659 0.266 . . . . 0.0 111.545 -179.725 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.977 HD21 HD21 ' A' ' 40' ' ' LEU . 21.9 mt -80.46 -31.72 37.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.952 -179.023 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.533 ' CD ' HG23 ' A' ' 31' ' ' ILE . 5.9 mtp-105 -91.38 20.39 5.28 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -179.238 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.575 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 0.6 OUTLIER -115.51 -45.67 2.9 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.11 -0.236 . . . . 0.0 111.635 -179.969 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.511 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 1.0 OUTLIER 150.99 -20.59 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 122.883 0.473 . . . . 0.0 111.082 179.55 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.15 112.11 10.67 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.129 -179.64 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.49 152.88 34.44 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.452 2.101 . . . . 0.0 112.177 179.807 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.977 HD21 HD21 ' A' ' 34' ' ' LEU . 4.3 mt -76.68 115.76 16.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.826 -179.993 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.62 164.47 3.99 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.033 -179.864 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.62 -13.17 32.28 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.574 2.183 . . . . 0.0 112.604 179.943 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -83.57 3.61 31.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.407 -179.947 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -95.48 20.16 9.91 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.693 0.282 . . . . 0.0 111.181 179.999 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 58.0 mm-40 58.83 34.24 23.57 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.896 179.927 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.0 p-10 -82.9 114.88 21.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.892 -179.975 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -168.72 178.03 4.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.959 179.991 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.42 148.02 43.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.117 179.981 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.533 HD11 ' CG ' ' A' ' 58' ' ' GLU . 90.7 mt -102.4 -177.11 3.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.834 179.955 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.77 176.33 5.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.867 -179.915 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 67.93 -136.35 30.94 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.577 179.965 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.44 -25.84 68.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.718 0.295 . . . . 0.0 111.094 -179.869 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.435 ' HD1' HG11 ' A' ' 68' ' ' VAL . 18.5 m-90 -96.65 38.77 1.19 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.912 0.387 . . . . 0.0 110.984 -179.956 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.419 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.1 OUTLIER -73.13 -52.21 5.59 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.011 179.947 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 88.4 Cg_endo -83.2 13.89 2.52 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.646 2.231 . . . . 0.0 112.803 179.973 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.411 ' CD2' ' HG ' ' A' ' 79' ' ' LEU . 96.1 m-85 -114.14 179.18 4.03 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.863 0.363 . . . . 0.0 110.999 -179.921 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.593 HH21 HG21 ' A' ' 71' ' ' VAL . 0.0 OUTLIER -131.14 149.8 52.43 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.886 -179.985 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.533 ' CG ' HD11 ' A' ' 49' ' ' LEU . 0.8 OUTLIER -129.91 169.87 14.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.923 -179.963 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.538 ' SG ' HD13 ' A' ' 40' ' ' LEU . 37.5 t -165.04 129.21 2.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.931 -179.951 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -91.84 83.24 5.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.848 179.837 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 1.11 HG21 HG23 ' A' ' 30' ' ' VAL . 3.5 mp -56.91 -50.93 73.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.122 -179.966 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.439 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 0.0 OUTLIER -114.82 172.41 3.64 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.483 179.965 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.439 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 16.7 Cg_exo -67.17 -4.28 11.34 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.554 2.169 . . . . 0.0 112.851 -179.874 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -146.81 29.09 1.02 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.874 179.933 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.791 ' O ' HD23 ' A' ' 66' ' ' LEU . 52.8 t -136.47 145.01 31.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.988 0.423 . . . . 0.0 111.383 179.934 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.791 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.0 OUTLIER -159.13 111.22 2.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.595 179.745 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.488 HD12 ' O ' ' A' ' 68' ' ' VAL . 0.3 OUTLIER -111.68 139.03 47.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.875 0.369 . . . . 0.0 111.103 -179.745 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.488 ' O ' HD12 ' A' ' 67' ' ' LEU . 40.9 t -88.94 139.36 17.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.801 179.84 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.403 ' CD1' ' N ' ' A' ' 69' ' ' TYR . 2.3 p90 -153.84 175.58 13.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.037 -179.952 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.601 ' HB2' HD11 ' A' ' 77' ' ' ILE . 4.5 tp -130.16 150.13 51.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.888 179.979 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.593 HG21 HH21 ' A' ' 57' ' ' ARG . 21.6 t -106.97 111.43 35.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.109 179.988 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.68 168.72 9.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.89 179.963 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.21 108.78 1.14 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.93 -179.922 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.1 t0 57.98 24.2 10.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.069 179.885 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -160.02 141.21 12.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.817 179.989 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.542 ' CB ' HD13 ' A' ' 2' ' ' LEU . 0.5 OUTLIER -119.93 148.16 43.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.896 -179.972 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.736 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.1 pp -131.49 134.32 60.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.26 -179.913 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 62.7 mt -84.93 135.39 34.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.671 179.781 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.411 ' HG ' ' CD2' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -93.73 -61.43 1.55 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.045 -179.927 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.4 175.05 4.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.973 0.416 . . . . 0.0 111.297 179.955 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.873 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.1 tm? -116.13 142.36 46.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.793 -179.971 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.873 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -148.5 -178.02 23.26 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.507 179.966 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 58.7 m -138.45 177.05 8.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.836 0.351 . . . . 0.0 110.907 179.944 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 8.4 t-80 -64.24 -29.99 71.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.943 -179.969 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.9 m -88.49 -29.95 19.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.895 -179.96 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.27 -68.13 0.55 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.886 -179.949 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.753 HD12 HD12 ' A' ' 66' ' ' LEU . 25.3 mt -69.7 -32.68 71.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.931 -179.979 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.938 179.983 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 8.0 mt . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.889 0.376 . . . . 0.0 110.927 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.67 152.69 40.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.957 -179.966 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.444 HD11 HD21 ' A' ' 78' ' ' LEU . 2.7 tp -120.75 145.27 47.69 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.874 179.931 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.485 ' HB2' HG22 ' A' ' 77' ' ' ILE . 8.0 t30 -129.88 171.89 12.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.752 179.957 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.453 HD11 HH21 ' A' ' 35' ' ' ARG . 4.6 mp -140.79 119.97 12.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.829 179.997 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -93.58 -176.56 4.12 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.917 179.973 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.7 mmtt -74.18 -31.36 62.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.863 -179.972 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.57 -39.76 73.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.99 -179.96 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -71.95 -33.24 68.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.885 -179.951 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -59.42 -47.09 86.78 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.989 179.964 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.542 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 0.9 OUTLIER -80.34 -13.45 59.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.12 179.892 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.421 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 3.2 m-20 -90.72 -11.88 38.31 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.037 179.715 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.596 ' O ' HD13 ' A' ' 18' ' ' LEU . 76.6 t80 -90.69 -65.47 1.01 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.214 -179.612 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.782 ' HA ' HD22 ' A' ' 18' ' ' LEU . 1.8 t70 -91.36 -36.34 13.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.95 -179.324 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.542 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 2.0 mptt -72.37 -36.54 68.75 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.125 -179.046 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.548 ' O ' HD23 ' A' ' 17' ' ' LEU . 1.8 tt -61.06 -32.07 71.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.996 0.427 . . . . 0.0 109.908 179.15 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.782 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.2 OUTLIER -62.51 -23.49 66.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.146 179.89 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -90.06 15.05 10.84 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.446 -179.995 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -127.6 47.91 2.32 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.823 0.344 . . . . 0.0 110.844 -179.979 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.27 30.05 65.5 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.482 -179.923 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.523 ' CD1' HD12 ' A' ' 18' ' ' LEU . 8.6 t80 -120.73 124.55 45.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.784 0.326 . . . . 0.0 110.765 -179.921 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.435 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 25.5 t0 -79.53 140.47 37.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.204 -179.744 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.691 ' HA ' HD23 ' A' ' 27' ' ' LEU . 7.3 p-10 -93.68 16.35 14.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.388 -179.977 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.5 t -90.06 -33.51 16.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.76 0.314 . . . . 0.0 111.348 -179.741 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.3 t -84.14 -38.14 13.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.573 -179.623 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.691 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.4 OUTLIER -59.86 -36.6 77.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.16 -179.667 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.529 ' O ' HD12 ' A' ' 32' ' ' LEU . 26.9 t30 -52.23 -46.07 65.57 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.076 -179.927 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.532 ' C ' HD12 ' A' ' 32' ' ' LEU . 5.3 mt-10 -64.94 -16.65 63.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.115 179.794 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 95.2 t -90.36 -74.37 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.034 0.445 . . . . 0.0 111.658 -179.541 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.7 mp -45.72 -44.03 4.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.874 -0.603 . . . . 0.0 112.263 -179.005 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.939 HD13 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -58.56 -19.65 39.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.72 0.295 . . . . 0.0 111.512 -179.431 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.939 ' N ' HD13 ' A' ' 32' ' ' LEU . 99.1 m -84.84 -28.74 25.85 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.83 0.348 . . . . 0.0 111.092 179.996 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.581 HD21 HD11 ' A' ' 40' ' ' LEU . 73.2 mt -89.9 -34.16 16.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.597 -179.349 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.453 HH21 HD11 ' A' ' 6' ' ' LEU . 4.5 mtp-105 -93.31 20.31 7.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.852 -179.346 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.592 ' HE3' HD23 ' A' ' 32' ' ' LEU . 10.3 mttm -110.04 -55.5 2.44 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 121.159 -0.216 . . . . 0.0 110.98 179.719 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.45 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 159.72 -20.53 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.27 179.613 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -83.38 118.33 71.25 Favored Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 116.713 -0.222 . . . . 0.0 111.083 -179.71 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -75.99 -179.39 5.16 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.462 2.108 . . . . 0.0 112.295 179.776 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.581 HD11 HD21 ' A' ' 34' ' ' LEU . 8.7 mt -98.89 157.35 16.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.779 179.968 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -96.56 157.75 34.84 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.024 -179.921 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.29 -3.28 13.68 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.632 2.221 . . . . 0.0 112.817 -179.982 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -92.6 17.71 9.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.694 0.283 . . . . 0.0 111.206 179.858 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -113.46 21.52 15.07 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.744 0.307 . . . . 0.0 110.985 179.901 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 62.79 43.92 6.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.828 179.986 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.7 p-10 -88.75 66.21 7.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.853 179.946 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -120.28 178.3 4.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.882 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.77 163.06 28.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.087 -179.991 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.777 HD21 ' OE1' ' A' ' 58' ' ' GLU . 5.4 mt -106.7 176.76 5.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.886 179.961 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.3 mmtt -116.67 157.07 26.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.041 179.989 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 82.68 -140.22 20.09 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.543 179.978 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm -58.47 -22.92 56.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.737 0.304 . . . . 0.0 111.219 179.999 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 5.0 m95 -96.17 38.48 1.19 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.928 179.953 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.435 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -75.4 -52.19 3.06 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.116 -179.922 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.435 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 90.1 Cg_endo -79.75 47.06 2.4 Favored 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 122.43 2.087 . . . . 0.0 112.347 -179.933 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.721 ' CD1' HD21 ' A' ' 79' ' ' LEU . 77.9 m-85 -154.57 178.37 10.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.856 179.878 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -137.17 134.76 36.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.004 -179.981 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.777 ' OE1' HD21 ' A' ' 49' ' ' LEU . 3.5 tt0 -98.8 171.85 7.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.79 179.891 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.535 ' SG ' HD13 ' A' ' 40' ' ' LEU . 14.8 t -168.36 116.66 0.71 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.901 179.985 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.557 ' CD2' HD22 ' A' ' 66' ' ' LEU . 11.3 m170 -93.31 79.04 4.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.915 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.585 HD11 ' HB3' ' A' ' 67' ' ' LEU . 2.5 mp -55.19 -26.87 19.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.193 179.843 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.425 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 2.7 mtpp -137.72 166.93 22.65 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.767 -179.751 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.425 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 48.2 Cg_endo -68.58 -2.57 9.51 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.351 2.034 . . . . 0.0 112.789 179.929 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -143.47 27.4 1.54 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.662 179.62 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.846 ' O ' HD23 ' A' ' 66' ' ' LEU . 60.9 t -136.9 146.38 28.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.208 -179.956 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.846 HD23 ' O ' ' A' ' 65' ' ' VAL . 5.8 mt -144.24 102.85 3.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.525 179.421 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.725 HD12 ' N ' ' A' ' 68' ' ' VAL . 5.2 tp -102.63 131.42 49.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.141 -179.651 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.725 ' N ' HD12 ' A' ' 67' ' ' LEU . 46.9 t -104.71 138.17 30.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.841 179.843 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.472 ' CD1' HD21 ' A' ' 76' ' ' LEU . 52.5 p90 -157.35 161.59 39.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.063 179.993 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.755 ' HB2' HD11 ' A' ' 77' ' ' ILE . 1.2 tp -109.36 -176.31 2.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.856 180.0 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.439 ' HA ' HD12 ' A' ' 76' ' ' LEU . 21.4 t -127.27 104.82 12.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.137 -179.99 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.62 172.61 8.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.871 179.923 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -57.99 102.55 0.11 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.906 179.893 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 58.17 24.75 11.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.961 -179.899 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -151.53 162.49 40.88 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.803 180.0 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.472 HD21 ' CD1' ' A' ' 69' ' ' TYR . 8.1 tp -123.41 147.66 46.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.832 -179.935 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.755 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.4 pp -131.95 128.92 60.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.154 -179.885 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.444 HD21 HD11 ' A' ' 4' ' ' LEU . 70.1 mt -73.83 155.4 38.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.684 179.744 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.721 HD21 ' CD1' ' A' ' 56' ' ' PHE . 0.3 OUTLIER -117.21 -68.16 0.94 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.94 -179.909 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.81 166.75 29.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.09 179.966 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.836 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.2 tm? -121.27 137.85 54.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.824 -179.952 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.836 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -154.83 -164.67 13.18 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.638 -179.988 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.9 p -142.57 176.67 8.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.892 0.377 . . . . 0.0 110.875 179.997 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 26.7 t-80 -59.27 -27.5 65.87 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.049 -179.904 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.6 m -78.85 -28.89 44.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.087 -179.878 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.412 ' HB3' HD12 ' A' ' 87' ' ' LEU . 1.2 tt0 -84.24 -72.98 0.44 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.023 -179.963 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.46 ' H ' HD12 ' A' ' 87' ' ' LEU . 6.6 mp -60.72 -39.93 90.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.021 -179.964 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.9 -179.961 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 tpt . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.886 0.374 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.559 HD13 ' HB2' ' A' ' 76' ' ' LEU . 3.2 pp -57.07 165.94 1.18 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.073 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.412 ' HD2' ' N ' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -82.36 153.99 25.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.916 -179.875 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.412 ' N ' ' HD2' ' A' ' 3' ' ' LYS . 3.1 tp -121.98 146.3 47.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.842 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.599 ' HB2' HG22 ' A' ' 77' ' ' ILE . 3.6 t30 -136.03 173.68 11.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.861 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.3 mp -144.56 138.02 27.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.981 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.3 mmtp -106.03 171.04 7.56 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.844 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 41.0 tttt -59.23 -30.08 67.99 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.99 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.1 t -70.42 -55.89 7.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.958 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.428 ' HE1' HD13 ' A' ' 67' ' ' LEU . 49.8 t80 -59.08 -33.8 71.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.973 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -60.56 -42.05 95.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.938 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.573 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 3.7 mtpt -89.97 -16.42 29.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.023 0.44 . . . . 0.0 111.464 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -90.75 -11.48 39.41 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.293 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.778 ' O ' HD13 ' A' ' 18' ' ' LEU . 13.9 t80 -90.34 -69.88 0.7 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.806 0.336 . . . . 0.0 111.349 -179.456 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.776 ' HA ' HD22 ' A' ' 18' ' ' LEU . 5.4 t0 -90.76 -29.6 17.53 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -178.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.573 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.6 OUTLIER -79.0 -17.76 54.81 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.374 -179.284 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.409 ' O ' ' HB3' ' A' ' 22' ' ' PHE . 38.2 tp -87.18 -34.5 19.0 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 179.295 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.778 HD13 ' O ' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -51.78 -49.43 62.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.851 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 pp -84.28 2.48 39.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.708 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.75 32.02 2.74 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.938 0.399 . . . . 0.0 110.781 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.86 22.99 43.59 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.524 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.534 ' CD1' HD12 ' A' ' 18' ' ' LEU . 35.9 t80 -103.77 139.28 39.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.832 0.349 . . . . 0.0 110.709 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.835 ' O ' HG12 ' A' ' 26' ' ' VAL . 45.6 t0 -70.48 97.79 1.35 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.823 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.682 ' HA ' HD23 ' A' ' 27' ' ' LEU . 2.1 p30 -68.56 -12.71 61.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.486 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.2 p -73.96 -24.78 59.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.684 -0.234 . . . . 0.0 111.358 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.835 HG12 ' O ' ' A' ' 23' ' ' ASP . 11.4 p -86.06 -26.2 6.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.465 -179.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.682 HD23 ' HA ' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -64.33 -37.24 86.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.833 0.349 . . . . 0.0 110.899 -179.897 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -55.04 -22.19 14.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.315 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -85.94 -46.8 10.22 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.78 0.324 . . . . 0.0 111.362 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.691 HG13 HD12 ' A' ' 31' ' ' ILE . 9.5 p -75.04 -46.35 40.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.182 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.691 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -66.19 -15.87 19.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.795 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.501 HD23 ' N ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -80.4 -27.87 38.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.257 -179.823 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.501 ' N ' HD23 ' A' ' 32' ' ' LEU . 58.0 m -87.34 -28.02 22.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.74 -179.324 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.792 HD21 HD21 ' A' ' 40' ' ' LEU . 65.7 mt -90.2 -33.05 16.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.671 -179.313 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.8 mtp-105 -93.29 20.21 7.31 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.457 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -116.12 -55.94 2.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.583 0.23 . . . . 0.0 111.071 179.673 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.457 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.1 OUTLIER 158.27 -20.48 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.14 179.612 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.87 111.68 9.11 Favored Pre-proline 0 CA--C 1.53 0.182 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.067 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.69 156.8 53.07 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.428 2.085 . . . . 0.0 112.181 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.792 HD21 HD21 ' A' ' 34' ' ' LEU . 67.2 mt -65.66 141.8 58.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.96 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -90.15 155.92 46.67 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.04 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.02 -9.06 24.04 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.636 2.224 . . . . 0.0 112.576 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.66 3.68 31.89 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.473 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -94.41 17.99 12.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.611 0.243 . . . . 0.0 111.255 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 54.97 37.36 28.72 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.784 0.326 . . . . 0.0 110.998 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -77.35 121.44 23.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.057 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -172.95 -170.04 0.62 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.886 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.19 134.24 37.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.048 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.454 HD21 ' HB2' ' A' ' 58' ' ' GLU . 3.9 mp -76.68 177.79 7.26 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.936 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.5 mtmm -113.89 152.65 30.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.891 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.36 -134.92 12.23 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.554 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.99 -13.0 60.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.654 0.264 . . . . 0.0 111.382 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 13.2 m95 -96.56 39.06 1.17 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.796 0.331 . . . . 0.0 110.875 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.461 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 6.9 tttm -69.25 -51.02 18.42 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.47 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 74.6 Cg_endo -78.36 47.88 2.54 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.305 2.003 . . . . 0.0 112.654 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.664 ' CE1' HD21 ' A' ' 79' ' ' LEU . 70.2 m-85 -154.24 170.96 20.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.808 0.337 . . . . 0.0 110.879 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.2 ttm105 -130.46 134.79 47.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.052 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.454 ' HB2' HD21 ' A' ' 49' ' ' LEU . 1.5 tm-20 -108.04 162.6 13.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.952 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 15.0 t -171.09 114.22 0.41 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.771 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.452 ' CG ' ' O ' ' A' ' 60' ' ' HIS . 16.9 p80 -90.18 85.11 6.17 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.077 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.581 HG21 HG23 ' A' ' 30' ' ' VAL . 3.8 mp -53.86 -26.85 14.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.968 179.669 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.542 ' HB2' HG23 ' A' ' 65' ' ' VAL . 18.3 mmmt -135.57 161.72 61.38 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.443 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.54 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 37.8 Cg_endo -66.16 -2.3 6.72 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.265 1.976 . . . . 0.0 112.89 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -137.99 23.7 2.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.794 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.812 ' O ' HD23 ' A' ' 66' ' ' LEU . 48.3 t -135.71 149.15 27.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.141 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.812 HD23 ' O ' ' A' ' 65' ' ' VAL . 2.1 mt -147.22 85.17 1.59 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.621 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.719 HD12 ' N ' ' A' ' 68' ' ' VAL . 4.9 tp -86.59 127.87 34.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.124 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.719 ' N ' HD12 ' A' ' 67' ' ' LEU . 52.0 t -102.4 138.08 28.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.011 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -151.88 170.74 19.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.954 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.747 ' HB2' HD11 ' A' ' 77' ' ' ILE . 7.8 tp -122.82 151.04 42.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.954 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 28.2 t -102.86 109.6 27.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.125 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.88 173.7 6.19 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.77 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -59.95 103.96 0.26 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.941 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 54.16 24.65 5.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.15 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -150.48 139.58 21.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.875 0.369 . . . . 0.0 110.955 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.559 ' HB2' HD13 ' A' ' 2' ' ' LEU . 6.2 tp -111.16 150.04 30.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.818 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.747 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.2 pp -135.88 130.34 48.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.44 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 80.6 mt -81.24 127.85 33.15 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.624 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.664 HD21 ' CE1' ' A' ' 56' ' ' PHE . 0.0 OUTLIER -88.34 -73.3 0.5 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.055 -179.77 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.455 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -155.92 174.27 15.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.987 -179.883 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.751 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.4 tm? -127.35 139.36 52.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.856 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.751 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -151.55 -176.69 24.59 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.453 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 70.2 m -132.85 167.59 19.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.854 0.359 . . . . 0.0 110.753 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -56.76 -31.16 64.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.923 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.5 m -90.33 -22.7 21.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.325 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.58 -67.54 0.78 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.367 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.526 HD12 ' CD1' ' A' ' 66' ' ' LEU . 25.8 mt -51.33 -26.02 6.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.363 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.885 179.989 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.673 0.273 . . . . 0.0 111.112 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.453 ' H ' HD12 ' A' ' 2' ' ' LEU . 2.1 mp -78.2 174.5 11.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.85 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.43 160.24 7.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.889 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.718 HD21 HD11 ' A' ' 78' ' ' LEU . 0.4 OUTLIER -125.21 155.86 39.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.043 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.811 ' HB2' HG22 ' A' ' 77' ' ' ILE . 0.8 OUTLIER -149.61 -178.08 6.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.944 -179.915 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 21.7 mt -140.23 141.02 35.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.847 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.633 ' HE2' HD13 ' A' ' 77' ' ' ILE . 14.4 mmtm -115.17 171.9 7.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.928 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.3 mtmm -70.19 -33.15 71.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.927 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.48 -34.38 78.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.827 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -66.51 -29.96 70.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.874 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -64.31 -48.61 74.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.6 mtpt -69.92 -24.46 63.38 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.042 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.523 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 7.1 m-20 -90.07 -22.98 21.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.02 0.438 . . . . 0.0 111.049 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.772 ' O ' HD23 ' A' ' 18' ' ' LEU . 73.4 t80 -90.9 -39.21 12.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.55 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -93.05 -58.06 2.44 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.105 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -47.21 68.58 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.672 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.57 HD23 ' CB ' ' A' ' 22' ' ' PHE . 3.0 tt -48.17 -39.48 21.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.235 0.54 . . . . 0.0 110.899 -179.136 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.772 HD23 ' O ' ' A' ' 14' ' ' PHE . 2.3 mm? -62.64 -32.43 73.48 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.904 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 19' ' ' LEU . 21.0 mt -90.07 12.73 16.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.301 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -113.86 29.55 7.92 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.874 0.369 . . . . 0.0 110.86 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.23 22.88 46.58 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.796 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.72 ' HD2' HD13 ' A' ' 18' ' ' LEU . 83.4 t80 -113.34 122.93 48.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.923 0.392 . . . . 0.0 110.817 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.417 ' O ' ' CD2' ' A' ' 22' ' ' PHE . 3.4 t0 -58.37 159.66 5.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.867 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.665 ' HA ' HD23 ' A' ' 27' ' ' LEU . 22.7 p-10 -108.69 -29.09 8.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.073 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.3 t -55.5 -23.57 26.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.169 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 20.6 t -79.46 -46.72 22.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.282 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.665 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -58.82 -28.57 66.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.94 -179.874 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -68.23 -15.77 63.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.228 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -90.14 -37.1 14.43 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.344 -179.679 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.771 HG13 ' CD1' ' A' ' 31' ' ' ILE . 7.5 p -82.49 -34.26 11.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.819 0.342 . . . . 0.0 111.155 -179.684 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.771 ' CD1' HG13 ' A' ' 30' ' ' VAL . 1.6 mp -76.47 -23.31 15.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.789 179.671 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.55 HD23 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -74.5 -24.77 59.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.076 -179.962 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.55 ' N ' HD23 ' A' ' 32' ' ' LEU . 89.4 m -90.1 -22.2 21.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.707 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.765 HD21 HD21 ' A' ' 40' ' ' LEU . 12.5 mt -90.45 -42.42 10.88 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 54.9 mtt180 -77.75 -40.27 41.56 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.467 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.2 OUTLIER -53.47 -55.78 22.39 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 121.197 -0.201 . . . . 0.0 111.485 -179.162 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.467 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 157.45 -20.41 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.087 179.736 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.37 123.03 27.45 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.159 -179.767 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.35 162.95 35.45 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.45 2.1 . . . . 0.0 112.264 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.765 HD21 HD21 ' A' ' 34' ' ' LEU . 83.6 mt -94.43 103.07 15.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.731 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -57.12 153.23 25.74 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.003 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -69.22 -10.35 28.75 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.504 2.136 . . . . 0.0 112.544 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.54 5.84 29.73 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.34 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -84.25 2.91 37.8 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.724 -0.216 . . . . 0.0 111.312 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 61.93 40.15 12.79 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.88 0.372 . . . . 0.0 111.033 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -78.71 87.21 4.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.767 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -120.53 176.06 5.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.038 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.1 175.26 0.54 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.11 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.73 HD11 HG22 ' A' ' 68' ' ' VAL . 0.2 OUTLIER -113.7 -175.74 2.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.775 179.973 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.5 mmtm -135.29 157.61 46.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.879 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.06 -116.61 4.71 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.578 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.62 -24.79 26.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.784 0.326 . . . . 0.0 110.997 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 10.7 m95 -97.43 33.18 2.06 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.879 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.475 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 12.1 tttm -57.73 -50.19 89.49 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.405 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 72.3 Cg_endo -77.3 4.39 5.92 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.323 2.015 . . . . 0.0 113.009 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -106.75 174.84 5.71 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.753 0.311 . . . . 0.0 110.926 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.438 ' O ' HG13 ' A' ' 68' ' ' VAL . 10.1 ttm180 -126.37 150.66 48.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.907 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.478 ' HG3' HD11 ' A' ' 49' ' ' LEU . 6.5 tt0 -111.51 172.16 7.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.893 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.527 ' SG ' HD13 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -156.86 116.71 3.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.788 179.947 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.714 ' CE1' HD22 ' A' ' 66' ' ' LEU . 10.3 m-70 -95.76 80.36 3.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.054 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.697 HD13 ' CG2' ' A' ' 30' ' ' VAL . 3.7 mp -67.23 -38.98 82.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.04 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.432 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 5.0 mttm -122.27 168.3 11.97 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.748 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.432 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 55.3 Cg_endo -69.67 -2.08 9.5 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.322 2.015 . . . . 0.0 112.824 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.9 p30 -144.35 26.88 1.44 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.773 179.676 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.854 ' O ' HD23 ' A' ' 66' ' ' LEU . 90.6 t -133.28 141.13 45.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.102 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.854 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.0 OUTLIER -157.19 94.06 1.37 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.632 179.749 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.571 HD12 ' O ' ' A' ' 68' ' ' VAL . 0.2 OUTLIER -101.72 136.55 41.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.918 -179.859 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.73 HG22 HD11 ' A' ' 49' ' ' LEU . 38.8 t -84.63 140.79 15.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.011 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.731 ' CD1' HD11 ' A' ' 76' ' ' LEU . 32.0 p90 -143.87 158.76 43.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.889 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.751 ' HB2' HD11 ' A' ' 77' ' ' ILE . 4.5 tp -105.37 164.24 12.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.886 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.2 t -114.55 115.93 51.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.058 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -111.39 170.72 7.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.811 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.5 p-10 -64.47 103.81 0.71 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.817 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.3 t70 60.46 19.53 9.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.198 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -151.34 143.09 23.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.843 0.354 . . . . 0.0 110.848 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.731 HD11 ' CD1' ' A' ' 69' ' ' TYR . 8.2 tt -119.35 139.8 51.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.914 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.811 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.4 pp -122.9 135.54 62.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.177 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.718 HD11 HD21 ' A' ' 4' ' ' LEU . 64.0 mt -76.29 143.03 41.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.75 179.804 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.4 -70.88 0.75 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.11 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.438 ' NH1' HD21 ' A' ' 87' ' ' LEU . 0.1 OUTLIER -154.57 173.04 16.86 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.95 0.405 . . . . 0.0 111.42 -179.859 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.624 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.4 tm? -112.67 133.62 54.61 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.91 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.624 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -136.25 171.78 22.69 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.427 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 18.1 m -135.16 170.15 16.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.777 0.322 . . . . 0.0 110.898 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -58.99 -29.37 67.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.993 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.4 t -90.01 -28.29 19.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.987 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.28 -71.74 0.37 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.022 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.635 HD12 HD12 ' A' ' 66' ' ' LEU . 13.6 mt -69.33 -34.87 75.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.03 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.242 -0.885 . . . . 0.0 110.901 -179.955 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mtp . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.877 0.37 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.9 mt 60.05 -177.25 0.1 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.918 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.403 ' HD2' ' N ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -52.86 151.36 4.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.044 179.97 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.742 HD11 HD11 ' A' ' 78' ' ' LEU . 7.6 tt -115.73 136.31 53.19 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.9 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.74 ' HB2' HG22 ' A' ' 77' ' ' ILE . 10.2 t30 -119.39 175.34 5.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.853 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 17.8 mt -141.98 114.05 8.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.011 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.8 mmpp? -95.64 -177.91 4.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.876 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.94 -31.2 56.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.847 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.4 -31.24 63.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.922 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -79.42 -30.91 42.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.98 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -59.5 -45.58 91.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.993 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.46 ' HA ' ' CB ' ' A' ' 16' ' ' LYS . 4.0 mttt -82.02 -18.96 41.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.261 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.485 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 6.3 m-20 -90.5 -17.39 27.17 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.083 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.501 ' O ' HD21 ' A' ' 18' ' ' LEU . 88.7 t80 -91.35 -65.48 1.01 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.22 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.453 ' O ' HD12 ' A' ' 19' ' ' LEU . 10.6 t70 -90.86 -45.62 8.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.138 -179.118 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.46 ' CB ' ' HA ' ' A' ' 12' ' ' LYS . 2.9 ttmt -70.55 -14.56 62.55 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.393 -179.195 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.485 ' HB2' ' HA ' ' A' ' 13' ' ' ASP . 26.6 tp -79.65 -39.12 32.16 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.787 HD13 ' CB ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -68.27 -43.11 78.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.711 179.734 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.453 HD12 ' O ' ' A' ' 15' ' ' ASP . 0.4 OUTLIER -65.51 -34.21 77.73 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.695 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -65.23 -24.62 67.39 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.002 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 133.13 41.93 0.17 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.546 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -124.34 140.67 52.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.802 0.334 . . . . 0.0 110.885 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.527 ' OD2' HG23 ' A' ' 26' ' ' VAL . 2.2 t70 -63.68 114.34 3.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.944 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.787 ' CB ' HD13 ' A' ' 18' ' ' LEU . 7.3 p-10 -72.08 -32.28 66.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.4 t -60.65 -49.84 75.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.383 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.527 HG23 ' OD2' ' A' ' 23' ' ' ASP . 60.1 t -51.46 -35.29 16.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.439 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.598 HD12 HD13 ' A' ' 31' ' ' ILE . 0.4 OUTLIER -66.42 -31.81 72.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.899 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -55.24 -47.24 75.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.931 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.4 ' HA ' HD22 ' A' ' 32' ' ' LEU . 2.6 mt-10 -57.39 -20.97 33.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.135 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.756 HG21 HG11 ' A' ' 65' ' ' VAL . 53.7 t -87.66 -69.4 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.011 0.434 . . . . 0.0 111.203 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.598 HD13 HD12 ' A' ' 27' ' ' LEU . 1.8 mp -48.9 -54.15 5.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.083 -179.327 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.741 HD23 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -55.27 -23.32 22.28 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.608 0.242 . . . . 0.0 111.281 -179.393 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.741 ' N ' HD23 ' A' ' 32' ' ' LEU . 82.0 m -89.93 -26.22 20.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.757 0.313 . . . . 0.0 111.157 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.718 HD21 HD21 ' A' ' 40' ' ' LEU . 73.0 mt -90.1 -30.49 17.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.402 -179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.419 ' CD ' HG23 ' A' ' 31' ' ' ILE . 38.1 mtm180 -95.17 20.16 9.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.722 -179.503 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.469 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -113.79 -55.58 2.49 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 121.1 -0.24 . . . . 0.0 111.071 179.966 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.469 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 157.43 -20.6 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.114 179.605 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.96 110.9 3.96 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.01 -179.723 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.22 147.76 33.55 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.53 2.154 . . . . 0.0 112.248 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.775 HD13 ' SG ' ' A' ' 59' ' ' CYS . 3.7 mt -80.89 111.9 17.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.763 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -57.67 155.32 21.86 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.137 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -67.19 -11.58 32.74 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.616 2.211 . . . . 0.0 112.531 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.94 4.77 28.2 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.405 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -94.72 19.06 10.53 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.189 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 11.3 mp0 60.29 41.33 16.6 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.88 0.371 . . . . 0.0 110.984 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.1 p-10 -88.5 96.52 10.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.851 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 56.4 m80 -143.78 177.52 8.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.895 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.88 167.3 6.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.195 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.671 HD11 ' HG3' ' A' ' 58' ' ' GLU . 6.3 mt -114.49 -179.0 3.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.917 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.3 mtpp -131.27 153.98 48.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.843 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 100.16 -109.07 3.62 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.608 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.3 mmtt -101.58 -23.35 14.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.746 0.307 . . . . 0.0 111.111 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 4.9 m95 -96.07 29.13 2.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.032 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.552 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 1.0 OUTLIER -59.04 -54.65 54.38 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.31 -179.93 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 27.1 Cg_endo -62.73 -10.49 19.92 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.267 1.978 . . . . 0.0 112.507 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.617 ' HD1' HD13 ' A' ' 70' ' ' LEU . 13.6 m-85 -99.52 168.26 10.08 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.802 0.334 . . . . 0.0 110.834 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.608 ' O ' HG13 ' A' ' 68' ' ' VAL . 5.0 ttp180 -120.51 150.05 41.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.922 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.671 ' HG3' HD11 ' A' ' 49' ' ' LEU . 2.0 tt0 -104.14 172.96 6.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.009 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.775 ' SG ' HD13 ' A' ' 40' ' ' LEU . 7.0 t -171.1 105.1 0.23 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.76 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.754 ' ND1' HD22 ' A' ' 66' ' ' LEU . 6.7 m170 -78.53 91.83 4.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.041 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.56 ' H ' HD12 ' A' ' 61' ' ' ILE . 4.1 mp -61.78 -41.33 90.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.957 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.448 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 0.2 OUTLIER -130.45 173.84 5.34 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.488 179.968 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.448 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 18.2 Cg_exo -66.15 -4.95 11.28 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.663 2.242 . . . . 0.0 112.796 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -145.13 29.71 1.17 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.866 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.878 ' O ' HD23 ' A' ' 66' ' ' LEU . 77.3 t -143.41 138.21 26.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.237 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.885 HD12 HD13 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -154.22 110.46 3.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.413 179.664 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.581 HD12 ' N ' ' A' ' 68' ' ' VAL . 0.1 OUTLIER -112.62 133.42 54.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.035 -179.781 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.612 HG22 HD11 ' A' ' 49' ' ' LEU . 37.8 t -91.17 142.68 12.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.785 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.592 ' CD2' HD11 ' A' ' 76' ' ' LEU . 54.2 p90 -154.33 163.3 40.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.855 0.359 . . . . 0.0 111.111 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.617 HD13 ' HD1' ' A' ' 56' ' ' PHE . 7.0 tp -110.4 169.63 8.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.776 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 18.4 t -123.19 109.38 23.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.264 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.16 161.53 18.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.8 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -43.91 -61.61 1.39 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.445 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -123.85 28.3 6.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.905 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.7 mp0 -160.16 174.33 14.42 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.843 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.592 HD11 ' CD2' ' A' ' 69' ' ' TYR . 4.4 tt -136.42 149.06 48.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.736 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.74 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.3 pp -132.4 130.09 59.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.329 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.742 HD11 HD11 ' A' ' 4' ' ' LEU . 52.0 mt -76.46 137.39 39.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.612 179.652 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.17 -69.05 0.77 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.217 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.66 153.83 23.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.372 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.606 ' C ' HD13 ' A' ' 81' ' ' LEU . 3.2 tm? -113.13 126.96 56.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.667 179.85 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.72 ' HA3' HD11 ' A' ' 87' ' ' LEU . . . -144.71 -171.48 14.57 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.557 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.465 ' O ' HD12 ' A' ' 87' ' ' LEU . 15.3 t -127.73 171.44 11.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.77 0.319 . . . . 0.0 110.841 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.583 ' HA ' HD11 ' A' ' 66' ' ' LEU . 2.3 t60 -60.33 -29.88 69.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.961 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 37.6 m -81.37 -24.99 36.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.008 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.19 -72.04 0.46 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.998 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.885 HD13 HD12 ' A' ' 66' ' ' LEU . 3.6 mp -63.24 -38.96 93.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.912 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.196 -0.907 . . . . 0.0 110.892 -179.956 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 ttp . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.734 0.302 . . . . 0.0 111.468 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.3 mt -123.59 174.34 7.49 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.997 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.0 tmmm? -71.74 152.11 43.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.867 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.525 HD11 HD11 ' A' ' 78' ' ' LEU . 2.3 tt -122.01 143.52 49.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.931 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.54 ' HB2' HG22 ' A' ' 77' ' ' ILE . 8.1 t30 -128.62 -175.76 3.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.898 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.401 HD11 HH22 ' A' ' 35' ' ' ARG . 2.7 mp -144.43 128.51 17.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.973 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.87 -175.24 2.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.909 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.22 -38.1 43.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.908 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.2 m -68.17 -41.08 82.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.915 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.419 ' CZ ' HD13 ' A' ' 78' ' ' LEU . 20.7 t80 -58.86 -30.46 67.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.938 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -62.86 -46.47 87.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.954 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.565 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 1.2 mmmm -81.92 -20.47 38.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.004 0.43 . . . . 0.0 111.185 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.404 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 20.1 m-20 -90.45 -10.94 41.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.082 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.702 ' O ' HD13 ' A' ' 18' ' ' LEU . 27.7 t80 -90.59 -69.0 0.75 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.875 0.369 . . . . 0.0 111.117 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.775 ' HA ' HD22 ' A' ' 18' ' ' LEU . 2.0 t70 -91.15 -32.71 15.72 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.565 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -76.08 -25.81 55.88 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 120.706 -0.398 . . . . 0.0 111.444 -178.99 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.439 ' O ' ' HB3' ' A' ' 22' ' ' PHE . 0.6 OUTLIER -75.64 -33.23 60.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.017 0.437 . . . . 0.0 110.037 179.182 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.775 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.2 OUTLIER -55.63 -42.55 75.13 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.85 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.542 ' C ' HD12 ' A' ' 19' ' ' LEU . 4.5 pp -83.99 -0.86 53.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.479 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.01 36.24 1.59 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.883 0.373 . . . . 0.0 110.94 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.18 25.8 46.83 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.397 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.441 ' CD1' HD12 ' A' ' 18' ' ' LEU . 11.5 t80 -114.08 130.47 56.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.722 0.296 . . . . 0.0 110.806 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.62 ' HB3' HG23 ' A' ' 26' ' ' VAL . 4.8 t70 -72.71 116.11 12.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.951 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.809 ' HA ' HD23 ' A' ' 27' ' ' LEU . 20.1 p-10 -68.33 -25.07 64.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.14 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.7 m -64.71 -21.15 66.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.296 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.62 HG23 ' HB3' ' A' ' 23' ' ' ASP . 21.8 t -83.93 -40.42 15.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.474 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.809 HD23 ' HA ' ' A' ' 24' ' ' ASP . 1.2 pp -57.78 -36.1 71.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.804 0.335 . . . . 0.0 111.129 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.694 ' O ' HD12 ' A' ' 32' ' ' LEU . 15.1 t-20 -57.36 -20.6 30.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.418 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -84.55 -37.49 21.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.693 0.282 . . . . 0.0 111.34 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.906 HG23 HG21 ' A' ' 61' ' ' ILE . 8.0 p -90.41 -36.62 8.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.849 -179.51 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.712 HD12 HG13 ' A' ' 30' ' ' VAL . 1.4 mp -71.13 -50.03 44.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.588 -179.262 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.93 HD13 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -57.91 -18.92 26.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.549 0.214 . . . . 0.0 111.462 -179.454 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.93 ' N ' HD13 ' A' ' 32' ' ' LEU . 85.1 m -84.75 -30.85 24.35 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.9 0.381 . . . . 0.0 110.703 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.795 HD21 HD21 ' A' ' 40' ' ' LEU . 66.0 mt -89.55 -30.73 18.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.444 -179.576 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.401 HH22 HD11 ' A' ' 6' ' ' LEU . 13.4 mtt-85 -93.55 20.18 7.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.774 -179.485 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.443 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 24.4 mttm -119.47 -55.45 2.12 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.576 0.227 . . . . 0.0 111.024 179.791 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.443 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 159.62 -20.65 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.199 179.751 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -65.89 111.24 5.92 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.028 -179.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.95 -179.97 3.87 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.48 2.12 . . . . 0.0 112.2 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.795 HD21 HD21 ' A' ' 34' ' ' LEU . 44.1 mt -102.44 117.45 34.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.9 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -61.45 157.04 48.77 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.042 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -69.03 -10.28 28.71 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.582 2.188 . . . . 0.0 112.548 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.87 11.19 18.66 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.31 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.443 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.4 m-85 -88.48 5.25 43.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.26 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 63.48 36.73 11.06 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.852 0.358 . . . . 0.0 110.897 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -80.65 110.37 16.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.902 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -148.56 174.76 11.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.846 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -92.44 128.26 38.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.088 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.776 HD11 ' CD ' ' A' ' 58' ' ' GLU . 24.7 mt -78.66 -167.9 1.23 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.847 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.2 mmtm -130.26 164.53 24.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.85 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 79.44 -122.78 5.89 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.456 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.32 -30.23 64.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.842 0.353 . . . . 0.0 110.831 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.469 ' HB3' HD12 ' A' ' 49' ' ' LEU . 33.1 m95 -98.45 27.35 4.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.928 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.517 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -75.94 -50.45 3.14 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.775 -179.678 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.517 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 53.0 Cg_endo -70.75 -3.26 12.31 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.165 1.91 . . . . 0.0 112.905 -179.564 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.431 ' CE2' ' HG2' ' A' ' 55' ' ' PRO . 39.3 m-85 -114.35 167.39 10.75 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.834 0.35 . . . . 0.0 110.749 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 11.1 ttm180 -117.03 141.54 48.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.046 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.776 ' CD ' HD11 ' A' ' 49' ' ' LEU . 1.0 OUTLIER -98.09 171.72 8.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.017 -179.835 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.79 ' SG ' HD13 ' A' ' 40' ' ' LEU . 5.8 t -169.94 122.09 0.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.776 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -101.72 87.31 3.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.082 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.906 HG21 HG23 ' A' ' 30' ' ' VAL . 3.5 mp -64.38 -51.2 71.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.871 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.562 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 16.7 mmmt -118.32 167.7 10.96 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.205 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.562 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 55.9 Cg_endo -70.86 1.75 4.84 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.081 1.854 . . . . 0.0 112.899 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -142.17 25.02 1.94 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.778 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.808 ' O ' HD23 ' A' ' 66' ' ' LEU . 44.1 t -140.17 149.75 21.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.177 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.808 HD23 ' O ' ' A' ' 65' ' ' VAL . 5.8 mt -146.41 101.84 3.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.878 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.633 ' HB3' HD11 ' A' ' 61' ' ' ILE . 3.4 tm? -95.09 131.97 40.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.953 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.67 HG22 ' OE1' ' A' ' 58' ' ' GLU . 81.8 t -107.24 110.95 33.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.362 179.107 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.722 ' CE1' HD11 ' A' ' 76' ' ' LEU . 26.9 p90 -124.81 162.65 23.85 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.101 -179.36 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.787 ' HB2' HD11 ' A' ' 77' ' ' ILE . 1.5 tp -118.46 133.36 55.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.867 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.511 HG22 ' N ' ' A' ' 72' ' ' LYS . 7.2 p -74.47 158.52 5.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.046 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.511 ' N ' HG22 ' A' ' 71' ' ' VAL . 1.3 tptt -159.35 171.57 19.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.834 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -59.53 100.09 0.07 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.986 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 52.83 23.94 3.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.238 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -148.88 147.05 28.23 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.833 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.722 HD11 ' CE1' ' A' ' 69' ' ' TYR . 0.5 OUTLIER -121.05 151.59 39.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.92 179.915 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.787 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.2 pp -133.42 130.91 57.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.269 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.525 HD11 HD11 ' A' ' 4' ' ' LEU . 67.7 mt -80.26 124.75 29.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.785 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.42 ' HG ' ' CD1' ' A' ' 56' ' ' PHE . 0.1 OUTLIER -87.24 -62.79 1.42 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.914 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.78 162.74 16.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.933 0.397 . . . . 0.0 111.214 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.883 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.0 tm? -104.56 143.11 33.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.817 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.883 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -147.1 177.5 25.35 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.451 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.3 m -143.05 171.66 13.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.854 0.359 . . . . 0.0 110.984 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -60.55 -29.23 69.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.93 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.4 t -88.89 -25.23 22.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.042 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.7 -68.2 0.72 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.962 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.401 HD12 ' CD1' ' A' ' 66' ' ' LEU . 22.8 mt -70.14 -39.14 75.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.051 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.312 -0.851 . . . . 0.0 110.873 -179.996 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mtm . . . . . 0 N--CA 1.489 1.49 0 CA-C-O 120.8 0.333 . . . . 0.0 111.079 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 60.84 169.73 0.09 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.022 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.66 151.75 19.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.818 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.773 HD11 HD11 ' A' ' 78' ' ' LEU . 1.1 tt -116.01 143.73 45.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.979 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.797 ' HB2' HG22 ' A' ' 77' ' ' ILE . 0.9 OUTLIER -123.6 -177.52 3.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.863 179.97 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -142.1 118.31 10.75 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.837 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -95.47 174.08 7.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.859 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 44.5 mttt -74.21 -41.84 60.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.825 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.1 p -66.66 -31.32 71.92 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.812 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -75.0 -33.86 61.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.833 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -65.0 -38.64 91.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.806 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.569 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 8.9 pttt -81.65 -25.83 35.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.094 0.473 . . . . 0.0 110.994 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.486 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 6.7 m-20 -90.66 -13.45 34.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.068 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.531 ' O ' HD21 ' A' ' 18' ' ' LEU . 20.5 t80 -91.7 -62.04 1.51 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.105 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.09 -43.67 9.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.287 -179.213 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.569 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 28.5 mttm -73.31 -17.08 61.35 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 120.908 -0.317 . . . . 0.0 111.477 -178.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.486 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 21.5 tp -76.79 -37.82 55.11 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.487 -0.561 . . . . 0.0 109.487 179.188 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.83 HD13 ' CB ' ' A' ' 24' ' ' ASP . 0.4 OUTLIER -67.16 -33.08 74.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.853 179.85 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.0 mt -74.9 -35.55 62.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.84 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.39 -22.69 67.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.099 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 133.09 41.03 0.19 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.463 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.405 ' CB ' ' HG ' ' A' ' 17' ' ' LEU . 32.6 t80 -124.04 144.31 49.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.868 0.366 . . . . 0.0 110.861 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.606 ' HB3' HG12 ' A' ' 26' ' ' VAL . 5.0 t0 -69.24 122.55 19.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.017 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.83 ' CB ' HD13 ' A' ' 18' ' ' LEU . 28.4 p-10 -78.94 -27.63 43.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.201 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.8 -56.15 13.46 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.399 -179.476 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.606 HG12 ' HB3' ' A' ' 23' ' ' ASP . 14.5 p -49.37 -28.48 3.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.629 -179.536 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.664 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -72.88 -33.26 65.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.9 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -55.28 -50.72 68.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.002 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -59.17 -23.92 62.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.094 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.527 ' CG1' HD13 ' A' ' 61' ' ' ILE . 91.1 t -77.72 -72.2 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.105 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.405 HG23 ' HG3' ' A' ' 35' ' ' ARG . 1.5 mp -49.37 -27.48 2.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.229 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.64 HD23 ' N ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -67.68 -36.4 80.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.858 179.852 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.64 ' N ' HD23 ' A' ' 32' ' ' LEU . 61.9 m -70.59 -27.62 64.24 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.497 -179.501 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.435 ' CD2' HD11 ' A' ' 40' ' ' LEU . 21.3 mt -90.26 -29.51 18.11 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.669 -179.375 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.577 ' HD2' HD13 ' A' ' 4' ' ' LEU . 10.8 mtp180 -97.09 20.21 11.67 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -179.275 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.495 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.5 OUTLIER -121.38 -55.83 1.92 Allowed 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 121.022 -0.271 . . . . 0.0 111.086 179.746 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.495 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 6.1 pttm 152.04 -20.44 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.036 0.534 . . . . 0.0 110.949 179.605 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.528 ' HB3' HG23 ' A' ' 33' ' ' THR . 1.3 tt0 -63.56 114.79 14.34 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.993 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.53 -179.67 4.32 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.416 2.078 . . . . 0.0 112.146 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.75 HD22 ' SG ' ' A' ' 59' ' ' CYS . 5.5 mp -108.33 142.71 38.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.962 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.06 157.88 74.23 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.107 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.66 -10.02 25.92 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.612 2.208 . . . . 0.0 112.663 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.19 20.6 8.96 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.142 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.538 ' HD2' HD23 ' A' ' 40' ' ' LEU . 8.4 m-30 -104.14 8.48 36.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.218 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 59.42 37.26 23.21 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.875 0.369 . . . . 0.0 110.878 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.3 p-10 -79.26 104.26 9.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.874 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -169.18 176.94 5.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.876 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.31 148.16 48.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.001 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.54 HD21 ' CD ' ' A' ' 58' ' ' GLU . 4.2 mt -96.85 178.78 5.18 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.825 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 11.6 ptpt -112.88 179.27 4.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.986 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 67.1 -145.17 45.94 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.601 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 9.4 mmtm -59.94 -20.45 57.52 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.638 0.256 . . . . 0.0 111.105 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 8.7 m95 -96.81 39.28 1.18 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.992 0.425 . . . . 0.0 110.827 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.44 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.8 OUTLIER -70.19 -49.14 18.66 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.426 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.44 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 86.2 Cg_endo -83.1 37.64 0.68 Allowed 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.572 2.181 . . . . 0.0 113.031 -179.563 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.492 ' CE1' HD21 ' A' ' 79' ' ' LEU . 20.9 m-85 -136.4 172.65 12.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.698 179.651 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 27.0 ttm105 -136.14 135.17 39.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.844 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.54 ' CD ' HD21 ' A' ' 49' ' ' LEU . 1.4 tt0 -96.0 167.63 11.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.892 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.75 ' SG ' HD22 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -166.56 111.93 0.8 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.807 179.927 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.405 ' N ' ' CD2' ' A' ' 60' ' ' HIS . 12.1 m170 -91.29 85.15 5.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.003 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.666 HG13 HD21 ' A' ' 40' ' ' LEU . 3.8 mp -58.51 -29.66 39.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.013 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.41 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 29.2 mttt -139.71 162.81 48.9 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.604 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.41 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 31.3 Cg_endo -63.71 -8.12 14.64 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.312 2.008 . . . . 0.0 112.77 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -133.3 26.52 4.15 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.591 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.878 ' O ' HD23 ' A' ' 66' ' ' LEU . 60.6 t -142.72 145.44 23.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.168 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.878 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.2 OUTLIER -148.46 97.76 2.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.646 179.707 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.762 HD22 ' N ' ' A' ' 68' ' ' VAL . 1.4 tm? -91.79 135.4 33.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.01 0.434 . . . . 0.0 111.1 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.762 ' N ' HD22 ' A' ' 67' ' ' LEU . 97.7 t -108.1 124.89 64.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.889 178.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.9 ' CD1' HD11 ' A' ' 76' ' ' LEU . 13.6 p90 -137.27 153.78 50.26 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.224 -179.389 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.719 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.9 OUTLIER -112.55 131.9 55.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.946 -179.997 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.523 HG22 ' N ' ' A' ' 72' ' ' LYS . 8.1 p -78.79 159.67 4.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.062 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.523 ' N ' HG22 ' A' ' 71' ' ' VAL . 3.6 tmtm? -143.66 160.61 40.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.864 179.466 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -40.27 -32.96 0.21 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.773 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.7 p-10 -164.93 30.97 0.06 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.922 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 71.7 mt-10 -153.35 158.34 41.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.868 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.9 HD11 ' CD1' ' A' ' 69' ' ' TYR . 6.0 tp -123.14 137.47 54.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.416 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.797 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.0 pp -127.42 134.67 65.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.424 -179.624 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.773 HD11 HD11 ' A' ' 4' ' ' LEU . 28.2 mt -86.99 124.75 33.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.858 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.519 HD11 ' HB2' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -82.43 -64.74 1.11 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.824 179.96 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.467 ' O ' HD22 ' A' ' 67' ' ' LEU . 0.4 OUTLIER -162.33 171.21 17.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.085 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.699 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.5 tm? -126.26 132.05 51.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.946 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.699 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -143.59 165.46 27.16 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.467 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 17.3 m -104.79 173.95 6.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.724 0.297 . . . . 0.0 110.983 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -64.36 -24.52 67.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.06 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 73.4 m -89.98 -26.83 20.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.08 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -73.91 -68.18 0.54 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.041 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.508 HD12 HD12 ' A' ' 66' ' ' LEU . 17.3 mt -72.15 -32.11 66.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.018 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.899 179.918 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mtm . . . . . 0 N--CA 1.487 1.425 0 N-CA-C 111.614 0.228 . . . . 0.0 111.614 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 mp 57.05 176.42 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.907 0.384 . . . . 0.0 111.007 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.55 172.07 8.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.77 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.9 tt -137.27 153.98 50.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.899 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.76 ' HB2' HG22 ' A' ' 77' ' ' ILE . 2.6 t30 -146.48 176.31 9.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.917 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.3 mt -137.74 131.24 31.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.867 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -103.28 166.06 10.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.915 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.63 -30.88 69.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.886 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.1 m -76.55 -41.73 45.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.863 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.589 ' HE2' HD13 ' A' ' 67' ' ' LEU . 22.5 t80 -71.45 -34.88 70.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.87 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -59.85 -40.71 89.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.802 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.546 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -89.98 -15.31 32.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.276 -179.959 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.457 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 5.0 m-20 -90.36 -11.12 41.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.185 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.697 ' O ' HD13 ' A' ' 18' ' ' LEU . 17.2 t80 -90.74 -67.08 0.87 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.978 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.843 ' HA ' HD22 ' A' ' 18' ' ' LEU . 2.3 m-20 -90.95 -34.37 15.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.163 -179.319 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.546 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -76.44 -19.42 58.08 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.508 -179.127 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.457 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 36.5 tp -82.47 -34.25 28.15 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.843 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.1 OUTLIER -50.98 -48.69 61.14 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.905 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 27.7 mt -90.16 12.86 16.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.467 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -111.09 31.65 5.89 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.878 0.371 . . . . 0.0 110.86 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.01 22.83 22.0 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.473 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.496 ' CD1' HD12 ' A' ' 18' ' ' LEU . 29.4 t80 -117.08 143.91 45.25 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.81 0.338 . . . . 0.0 110.851 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.567 ' HB3' HG23 ' A' ' 26' ' ' VAL . 3.9 t70 -91.92 111.05 22.43 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.856 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.834 ' HA ' HD23 ' A' ' 27' ' ' LEU . 36.2 p-10 -53.89 -27.31 29.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.202 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.8 t -60.73 -19.39 58.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.246 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.567 HG23 ' HB3' ' A' ' 23' ' ' ASP . 21.8 t -88.55 -40.7 13.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.691 0.281 . . . . 0.0 111.486 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.834 HD23 ' HA ' ' A' ' 24' ' ' ASP . 1.2 pp -57.65 -36.48 71.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.118 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -62.78 -28.01 69.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.009 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -75.06 -34.2 61.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.186 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 1.101 HG23 HG21 ' A' ' 61' ' ' ILE . 10.9 p -89.96 -47.29 14.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.395 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.578 HD12 HG13 ' A' ' 30' ' ' VAL . 1.6 mp -58.05 -25.14 25.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.86 0.362 . . . . 0.0 110.707 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.867 HD23 ' N ' ' A' ' 33' ' ' THR . 0.2 OUTLIER -70.52 -52.5 21.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.27 -179.721 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.867 ' N ' HD23 ' A' ' 32' ' ' LEU . 89.3 m -66.56 -23.97 66.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.918 -179.349 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.579 HD21 HD21 ' A' ' 40' ' ' LEU . 76.2 mt -89.95 -33.61 16.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.756 0.312 . . . . 0.0 111.591 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.1 mtt180 -98.81 20.22 13.48 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -179.301 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.51 ' O ' ' HB3' ' A' ' 37' ' ' LYS . 4.0 mtmt -108.69 -55.88 2.34 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.033 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.51 ' HB3' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 150.83 -20.38 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.122 0.569 . . . . 0.0 110.801 179.622 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.62 126.36 89.48 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.605 -0.27 . . . . 0.0 110.987 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -75.08 169.41 22.65 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.449 2.099 . . . . 0.0 112.278 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.579 HD21 HD21 ' A' ' 34' ' ' LEU . 4.6 mt -95.82 126.09 40.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.802 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.407 ' HB2' ' CE1' ' A' ' 44' ' ' PHE . 5.4 m-20 -72.26 162.16 75.21 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.055 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -68.89 -27.54 30.65 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.609 2.206 . . . . 0.0 112.304 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -64.76 -15.54 61.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.326 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.407 ' CE1' ' HB2' ' A' ' 41' ' ' ASP . 24.6 m-85 -79.17 -0.19 30.85 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.57 -0.287 . . . . 0.0 111.552 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 67.83 48.56 1.01 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.959 0.409 . . . . 0.0 110.843 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.2 p-10 -88.92 89.02 7.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.772 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' HIS . . . . . 0.405 ' HA ' ' NH1' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -151.48 -179.88 7.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.044 -179.796 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -84.46 125.08 32.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.112 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 90.0 mt -72.3 -178.57 2.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.898 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -110.15 172.75 6.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.928 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 78.21 -117.96 4.8 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.587 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.2 mttm -89.63 -18.03 27.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.578 0.228 . . . . 0.0 111.298 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 16.5 m-90 -96.18 38.26 1.2 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.805 0.336 . . . . 0.0 111.083 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.435 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 5.0 mtpt -83.96 -50.92 0.62 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.042 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 17.0 Cg_exo -66.62 -8.84 22.29 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.505 2.137 . . . . 0.0 112.475 179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.599 ' HA ' HD12 ' A' ' 70' ' ' LEU . 13.1 m-85 -105.75 -171.64 1.94 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.904 0.383 . . . . 0.0 111.066 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.405 ' NH1' ' HA ' ' A' ' 47' ' ' HIS . 4.1 ttm-85 -138.92 136.22 35.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.847 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.454 ' OE2' HD22 ' A' ' 87' ' ' LEU . 6.9 tp10 -106.19 162.79 13.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.114 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.559 ' SG ' HD13 ' A' ' 40' ' ' LEU . 3.1 t -162.71 117.45 1.78 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.906 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -90.28 89.47 7.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.932 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 1.101 HG21 HG23 ' A' ' 30' ' ' VAL . 4.0 mp -60.53 -31.4 48.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.069 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.5 mttm -141.42 172.86 5.45 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.765 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -66.78 -6.35 15.42 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.706 2.27 . . . . 0.0 112.663 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -142.27 26.09 1.84 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.879 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.616 ' C ' HD23 ' A' ' 66' ' ' LEU . 64.5 t -141.06 140.85 32.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.184 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.616 HD23 ' C ' ' A' ' 65' ' ' VAL . 0.0 OUTLIER -159.14 110.3 2.06 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.759 179.863 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.589 HD13 ' HE2' ' A' ' 10' ' ' PHE . 0.2 OUTLIER -108.3 131.8 54.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.712 -179.973 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.448 ' O ' HD12 ' A' ' 67' ' ' LEU . 41.5 t -88.68 140.45 15.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.98 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.414 ' CE2' ' HB2' ' A' ' 59' ' ' CYS . 2.6 p90 -146.77 159.36 43.6 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.918 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.778 ' HB2' HD11 ' A' ' 77' ' ' ILE . 2.8 tp -109.24 171.98 7.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.856 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 28.7 t -123.26 103.71 13.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.181 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.06 168.37 10.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.743 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -58.76 104.04 0.2 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.832 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 57.0 22.05 6.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.122 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -148.68 138.21 21.95 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.748 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.7 tp -108.03 143.93 36.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.933 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.778 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.2 pp -131.64 130.26 62.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.201 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.403 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 74.9 mt -76.28 135.4 39.62 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.747 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.36 -62.68 1.29 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.137 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.69 164.59 18.99 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.931 0.396 . . . . 0.0 111.472 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.612 ' C ' HD13 ' A' ' 81' ' ' LEU . 3.1 tm? -125.19 126.73 45.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.598 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.447 ' HA3' HD11 ' A' ' 87' ' ' LEU . . . -146.31 -174.9 18.86 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.557 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 22.7 m -110.55 174.46 5.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.91 0.386 . . . . 0.0 111.031 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.33 -25.3 65.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.981 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 69.6 m -86.93 -15.97 37.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.281 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -86.79 -69.28 0.69 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.02 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.464 ' H ' HD12 ' A' ' 87' ' ' LEU . 6.5 mp -63.15 -41.23 99.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.079 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.208 -0.901 . . . . 0.0 110.958 179.961 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.3 mtp . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.804 0.335 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.89 HD13 ' HB2' ' A' ' 76' ' ' LEU . 0.6 OUTLIER -153.73 152.6 30.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.917 179.978 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.9 151.32 47.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.892 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.2 tt -121.21 154.38 36.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.83 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.715 ' HB2' HG22 ' A' ' 77' ' ' ILE . 0.7 OUTLIER -147.54 155.81 42.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.901 179.978 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.9 mp -124.78 126.78 46.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.976 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -100.52 158.97 15.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.957 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.3 tttm -61.26 -31.74 71.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.899 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 6.6 m -66.1 -28.96 69.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.032 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.692 ' HE1' HD13 ' A' ' 67' ' ' LEU . 55.7 t80 -73.87 -32.4 63.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.134 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -79.29 -30.08 42.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.056 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.03 -16.2 30.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.387 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -81.74 -30.48 32.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.639 0.257 . . . . 0.0 111.148 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.887 ' CE2' HD13 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -90.42 -53.02 4.62 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 179.538 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.604 ' HA ' HD22 ' A' ' 18' ' ' LEU . 11.9 m-20 -51.48 -34.47 35.84 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.06 0.457 . . . . 0.0 110.074 178.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.54 -27.98 37.42 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.097 179.044 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.2 mt -76.12 -41.5 49.92 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.1 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.604 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.0 OUTLIER -54.13 -33.18 57.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.992 179.914 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 mt -90.06 -5.86 56.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.617 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.64 38.01 1.24 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.846 0.355 . . . . 0.0 111.068 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.67 26.71 41.27 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.502 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.516 ' CD1' HD12 ' A' ' 18' ' ' LEU . 10.6 t80 -119.51 128.39 53.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.814 0.34 . . . . 0.0 110.88 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.41 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 8.0 t70 -84.85 131.28 34.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.996 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.7 p-10 -56.9 -21.8 32.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.099 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.6 t -48.15 -53.45 16.69 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.821 0.343 . . . . 0.0 110.955 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.42 ' HB ' ' CZ ' ' A' ' 22' ' ' PHE . 39.2 t -65.14 -35.11 74.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.669 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.887 HD13 ' CE2' ' A' ' 14' ' ' PHE . 1.1 tp -59.14 -33.52 70.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.669 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -59.35 -47.09 86.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.912 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -63.14 -40.06 96.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.932 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 94.6 t -66.27 -72.46 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.09 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.796 HD13 ' CD1' ' A' ' 27' ' ' LEU . 1.2 mp -45.76 -33.45 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 121.152 0.501 . . . . 0.0 110.523 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.839 HD23 ' N ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -55.51 -59.97 4.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.17 179.35 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.839 ' N ' HD23 ' A' ' 32' ' ' LEU . 64.6 m -54.34 -24.45 19.39 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.307 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 31' ' ' ILE . 17.7 mt -73.36 -62.08 1.6 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.844 0.354 . . . . 0.0 110.961 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.4 mtp180 -67.9 -49.0 64.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.029 0.442 . . . . 0.0 110.921 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.617 ' HE2' HD21 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -68.55 -13.77 62.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.533 179.882 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.547 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 1.3 pttm 52.59 70.73 0.54 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.679 -179.549 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.699 ' HB3' HG23 ' A' ' 33' ' ' THR . 1.3 tm-20 -81.56 142.48 49.84 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.636 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -61.32 104.8 0.31 Allowed 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.366 2.044 . . . . 0.0 112.135 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.445 HD22 ' CD2' ' A' ' 44' ' ' PHE . 57.3 mt -68.3 137.61 54.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.99 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -87.29 158.42 52.19 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.82 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.32 -26.72 63.65 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.504 2.136 . . . . 0.0 112.224 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -67.68 -21.46 65.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.094 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.445 ' CD2' HD22 ' A' ' 40' ' ' LEU . 3.2 m-85 -56.5 -27.64 57.75 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.003 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 63.29 61.33 1.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.939 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.0 p-10 -91.45 77.35 5.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.871 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -125.89 -175.29 3.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.043 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.07 166.97 21.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.253 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.572 HD12 ' N ' ' A' ' 49' ' ' LEU . 1.0 OUTLIER -104.44 -167.55 1.37 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.885 179.883 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -126.1 151.38 47.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.864 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 92.12 -136.03 13.03 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.564 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.22 -11.81 61.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.614 0.245 . . . . 0.0 111.352 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 17.3 m-90 -96.69 39.33 1.17 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.969 0.414 . . . . 0.0 111.007 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.508 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 2.4 ttmm -72.71 -50.25 7.62 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.468 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.508 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 63.1 Cg_endo -74.43 0.43 8.61 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.336 2.024 . . . . 0.0 112.932 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.447 ' CD1' HD13 ' A' ' 70' ' ' LEU . 39.4 m-85 -102.83 179.78 4.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.808 0.337 . . . . 0.0 110.817 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.42 ' NH1' HG21 ' A' ' 71' ' ' VAL . 12.1 ttm180 -147.14 134.39 20.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.833 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.5 ' HG3' HG22 ' A' ' 68' ' ' VAL . 4.0 tt0 -95.85 162.93 13.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.002 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.433 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 21.6 t -163.87 105.91 0.93 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.847 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.434 ' CD2' ' N ' ' A' ' 60' ' ' HIS . 6.8 m170 -84.79 94.96 8.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.955 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.547 HD11 ' HB3' ' A' ' 67' ' ' LEU . 4.4 mp -66.09 -25.22 35.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.913 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.43 169.96 10.67 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.766 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -70.86 1.2 5.4 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.798 2.332 . . . . 0.0 112.866 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -144.38 24.06 1.6 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.845 0.355 . . . . 0.0 110.778 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.813 ' O ' HD23 ' A' ' 66' ' ' LEU . 41.4 t -136.49 153.13 30.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.919 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.813 HD23 ' O ' ' A' ' 65' ' ' VAL . 3.7 mt -145.56 112.27 5.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.775 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.742 HD12 ' N ' ' A' ' 68' ' ' VAL . 4.7 tp -106.66 128.74 54.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.018 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.742 ' N ' HD12 ' A' ' 67' ' ' LEU . 66.9 t -108.4 134.16 51.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.753 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.433 ' CE2' ' HB2' ' A' ' 59' ' ' CYS . 2.8 p90 -144.07 165.43 27.81 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.886 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.466 ' HB2' HD11 ' A' ' 77' ' ' ILE . 8.3 tp -100.24 157.53 16.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.871 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.42 HG21 ' NH1' ' A' ' 57' ' ' ARG . 21.4 t -113.31 103.82 16.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.116 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.9 tttp -83.17 161.74 21.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.719 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -44.02 -35.87 2.27 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.443 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.0 p-10 -156.0 29.66 0.36 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.82 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -152.5 156.6 39.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.814 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.89 ' HB2' HD13 ' A' ' 2' ' ' LEU . 11.8 tp -119.67 139.92 51.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.715 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.715 HG22 ' HB2' ' A' ' 5' ' ' ASN . 1.8 pp -133.35 127.95 54.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.212 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.43 HD22 HD21 ' A' ' 67' ' ' LEU . 58.9 mt -70.22 139.81 52.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.95 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.32 -73.72 0.65 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.058 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.08 174.61 13.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.875 0.369 . . . . 0.0 111.364 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.897 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.1 tm? -120.93 140.65 51.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.838 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.897 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -147.13 -176.85 21.2 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.572 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.1 t -139.81 -172.03 3.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.818 0.342 . . . . 0.0 110.912 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.8 t-160 -72.63 -28.66 62.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.965 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.01 -23.06 21.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.088 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -85.74 -71.12 0.55 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.874 0.368 . . . . 0.0 111.003 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.529 HD12 ' CD1' ' A' ' 66' ' ' LEU . 72.6 mt -60.45 -40.66 91.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.992 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.175 -0.917 . . . . 0.0 110.976 179.946 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mpp? . . . . . 0 N--CA 1.487 1.41 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.3 mt -90.65 161.28 15.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.897 0.38 . . . . 0.0 110.857 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.42 142.37 55.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.781 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.555 HD12 HD23 ' A' ' 76' ' ' LEU . 7.7 tp -114.03 154.45 27.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.013 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.719 ' HB2' HG22 ' A' ' 77' ' ' ILE . 2.0 t30 -138.9 176.04 9.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.832 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.0 mt -138.9 129.06 25.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.997 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 25.8 mmtm -97.21 -177.45 3.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.784 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.83 -33.85 39.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.924 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.6 m -74.59 -34.34 62.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.016 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.473 ' HE1' HD13 ' A' ' 67' ' ' LEU . 36.0 t80 -61.16 -29.22 69.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.075 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -71.55 -42.39 67.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.02 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.549 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 2.6 mtmm -78.54 -19.51 52.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.284 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.406 ' C ' ' HB2' ' A' ' 17' ' ' LEU . 20.7 m-20 -90.4 -10.39 44.05 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.095 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.536 ' O ' HD21 ' A' ' 18' ' ' LEU . 6.7 t80 -91.17 -66.03 0.96 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.801 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -91.46 -37.73 12.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.89 -0.595 . . . . 0.0 112.15 -179.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.549 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -75.49 -18.27 59.89 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 120.941 -0.304 . . . . 0.0 111.677 -178.799 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.43 HD11 ' HG3' ' A' ' 86' ' ' GLU . 1.2 tt -79.81 -34.1 39.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.977 0.418 . . . . 0.0 109.891 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.782 HD13 ' HB3' ' A' ' 24' ' ' ASP . 0.8 OUTLIER -66.65 -33.82 76.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.799 179.641 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.9 mt -80.57 -36.05 33.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.911 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -57.61 -22.73 47.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.086 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.98 36.7 0.27 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.687 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.406 ' CE2' ' O ' ' A' ' 23' ' ' ASP . 75.0 t80 -122.11 163.3 19.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.72 0.295 . . . . 0.0 110.951 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.406 ' O ' ' CE2' ' A' ' 22' ' ' PHE . 9.9 t70 -86.31 123.08 31.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.941 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.782 ' HB3' HD13 ' A' ' 18' ' ' LEU . 9.4 p-10 -77.85 -31.61 51.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.985 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.0 t -60.86 -40.79 94.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.35 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 45.3 t -58.66 -37.99 68.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.341 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.562 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.6 OUTLIER -60.83 -33.58 73.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.975 -179.885 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.412 ' N ' ' HG ' ' A' ' 27' ' ' LEU . 5.6 t30 -58.36 -29.0 65.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.122 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -72.04 -44.39 63.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.031 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.645 HG13 HD12 ' A' ' 31' ' ' ILE . 10.8 p -80.13 -46.15 22.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.148 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.645 HD12 HG13 ' A' ' 30' ' ' VAL . 1.6 mp -58.42 -29.96 39.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.921 0.391 . . . . 0.0 110.657 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.448 HD23 ' C ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -67.1 -24.7 65.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.166 -179.791 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 51.4 m -90.21 -24.0 21.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.568 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.0 mt -90.11 -38.8 13.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.593 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.566 ' CD ' HG23 ' A' ' 31' ' ' ILE . 51.9 mtp85 -90.56 20.15 4.81 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -179.292 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.479 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 2.2 mttm -110.98 -55.76 2.45 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 121.106 -0.238 . . . . 0.0 111.012 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.479 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 155.65 -20.5 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.109 179.669 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -78.24 113.05 30.31 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.152 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -74.58 -179.55 4.95 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.545 2.163 . . . . 0.0 112.108 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.47 HD13 ' SG ' ' A' ' 59' ' ' CYS . 15.6 mt -87.78 116.1 25.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.822 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -60.9 159.38 27.21 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.999 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.46 -9.34 25.03 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.602 2.201 . . . . 0.0 112.574 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.14 8.95 24.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.293 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -92.39 11.7 25.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.658 0.266 . . . . 0.0 111.294 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 60.93 32.05 19.98 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.803 0.335 . . . . 0.0 110.984 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -69.26 98.61 1.06 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.81 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -144.27 177.17 8.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.888 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.53 129.82 34.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.135 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.401 HD11 ' HG3' ' A' ' 58' ' ' GLU . 21.8 mt -72.63 -178.93 2.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.868 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.3 mtmt -120.36 169.72 10.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.924 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 79.12 -118.25 4.74 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.492 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.53 -21.75 30.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.663 0.268 . . . . 0.0 111.221 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 6.2 m95 -96.27 38.71 1.18 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.848 0.356 . . . . 0.0 110.885 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.438 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 11.6 ttmt -73.77 -51.29 5.26 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.237 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.438 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 89.2 Cg_endo -79.77 47.1 2.41 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.307 2.005 . . . . 0.0 112.481 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.419 ' HA ' HD11 ' A' ' 70' ' ' LEU . 96.7 m-85 -157.65 175.92 13.29 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.868 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.568 ' O ' HG13 ' A' ' 68' ' ' VAL . 4.3 ttm180 -130.96 134.39 46.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.853 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.401 ' HG3' HD11 ' A' ' 49' ' ' LEU . 2.6 tm-20 -104.83 167.64 9.59 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.982 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.47 ' SG ' HD13 ' A' ' 40' ' ' LEU . 6.3 t -171.1 115.4 0.42 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.659 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.418 ' CG ' ' O ' ' A' ' 60' ' ' HIS . 12.2 p80 -93.33 109.55 21.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.058 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.49 HD12 ' N ' ' A' ' 61' ' ' ILE . 4.3 mp -77.92 -27.68 15.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.754 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.43 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 12.6 mtpp -133.18 168.94 15.4 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.6 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.43 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 14.8 Cg_exo -68.72 -0.3 5.89 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.634 2.222 . . . . 0.0 113.015 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -144.47 27.61 1.37 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.811 0.338 . . . . 0.0 110.801 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.809 ' O ' HD23 ' A' ' 66' ' ' LEU . 48.3 t -136.38 148.72 27.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.037 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.809 HD23 ' O ' ' A' ' 65' ' ' VAL . 2.0 mt -147.06 93.24 2.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.78 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.622 HD12 ' N ' ' A' ' 68' ' ' VAL . 3.2 tp -93.81 120.45 34.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.85 -179.785 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.622 ' N ' HD12 ' A' ' 67' ' ' LEU . 47.7 t -94.32 135.35 28.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.04 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.879 ' CD1' HD11 ' A' ' 76' ' ' LEU . 29.6 p90 -147.36 168.2 22.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.101 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.741 ' HB2' HD11 ' A' ' 77' ' ' ILE . 1.6 tp -122.18 143.36 49.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.694 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -102.07 99.15 7.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.246 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.416 ' O ' ' C ' ' A' ' 73' ' ' ASP . 0.0 OUTLIER -77.44 167.09 22.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.72 179.883 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.416 ' C ' ' O ' ' A' ' 72' ' ' LYS . 1.2 p30 -30.04 -60.75 0.17 Allowed 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.196 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -143.67 30.82 1.33 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.789 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -154.51 109.44 3.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.194 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.879 HD11 ' CD1' ' A' ' 69' ' ' TYR . 1.6 tp -70.32 141.82 52.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.79 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.741 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.1 pp -129.8 136.54 58.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.321 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.465 HD11 HD21 ' A' ' 4' ' ' LEU . 82.0 mt -79.41 137.88 37.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.835 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.438 HD12 ' HD2' ' A' ' 80' ' ' ARG . 0.2 OUTLIER -96.92 -72.8 0.63 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.959 179.968 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.438 ' HD2' HD12 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -158.16 174.01 15.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.191 179.953 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.607 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.3 tm? -120.04 131.76 55.23 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.746 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.607 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -145.4 -174.82 17.97 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.545 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 20.0 m -152.55 -173.31 4.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.905 0.383 . . . . 0.0 110.805 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 -65.72 -30.57 71.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.854 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 55.9 m -89.91 -30.27 17.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.94 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.43 ' HG3' HD11 ' A' ' 17' ' ' LEU . 1.9 mm-40 -74.77 -73.39 0.24 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.943 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.426 HD12 HD12 ' A' ' 66' ' ' LEU . 33.9 mt -65.64 -34.19 77.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.842 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.946 179.983 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 ptm . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.783 0.325 . . . . 0.0 111.268 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 20.0 mt 59.87 160.96 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.935 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.45 151.48 20.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.815 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.1 tp -116.49 148.75 40.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.852 0.358 . . . . 0.0 111.051 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.496 ' HB2' HG22 ' A' ' 77' ' ' ILE . 5.9 t30 -140.67 -179.13 5.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.823 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.429 HD21 ' NH2' ' A' ' 35' ' ' ARG . 3.1 mp -144.62 143.69 30.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.929 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.6 mmtt -114.88 -177.92 3.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.906 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.46 -31.46 67.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.812 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.84 -33.59 68.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.928 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.484 ' CZ ' HD13 ' A' ' 78' ' ' LEU . 41.1 t80 -80.06 -32.13 39.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.938 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -59.94 -38.56 82.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.906 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.558 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 2.7 pttp -86.27 -22.68 26.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.165 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -90.7 -10.43 43.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.241 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.701 ' O ' HD13 ' A' ' 18' ' ' LEU . 93.9 t80 -90.58 -67.46 0.85 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.16 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.827 ' HA ' HD22 ' A' ' 18' ' ' LEU . 0.5 OUTLIER -91.0 -31.46 16.31 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -179.21 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.558 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -77.91 -26.52 49.1 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.482 -179.07 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.54 -31.34 60.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.92 0.39 . . . . 0.0 110.17 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.827 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.2 OUTLIER -55.68 -43.3 76.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.045 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.455 ' O ' HD12 ' A' ' 19' ' ' LEU . 4.0 pp -90.11 15.02 10.95 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.494 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -113.64 33.1 5.36 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.795 0.331 . . . . 0.0 110.813 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.55 27.08 23.38 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.304 -179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.455 ' CD1' ' N ' ' A' ' 23' ' ' ASP . 14.3 t80 -115.2 149.7 37.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.83 0.348 . . . . 0.0 110.824 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.455 ' N ' ' CD1' ' A' ' 22' ' ' PHE . 46.2 t0 -92.52 98.75 11.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.91 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -54.06 -30.21 47.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.244 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.4 m -58.88 -26.22 64.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.161 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.47 ' O ' HG23 ' A' ' 30' ' ' VAL . 38.3 t -84.6 -36.47 11.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.299 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.579 ' CD2' HD21 ' A' ' 18' ' ' LEU . 0.2 OUTLIER -55.53 -35.8 66.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.85 -179.925 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.448 ' O ' ' HB3' ' A' ' 32' ' ' LEU . 8.7 t-20 -53.41 -66.09 0.45 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.172 -179.678 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -46.9 -28.57 1.64 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.484 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 26' ' ' VAL . 37.9 t -75.37 -69.59 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.306 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.1 mp -55.97 -24.38 17.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.082 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.487 HD23 ' C ' ' A' ' 32' ' ' LEU . 0.1 OUTLIER -71.23 -21.17 62.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.97 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.6 m -90.0 -33.55 16.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.881 0.372 . . . . 0.0 111.464 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.774 HD21 HD21 ' A' ' 40' ' ' LEU . 14.1 mt -90.17 -26.33 20.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.786 -179.451 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.429 ' NH2' HD21 ' A' ' 6' ' ' LEU . 26.6 mtt180 -99.01 20.29 13.57 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -179.138 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.459 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 2.7 mtmt -116.47 -55.63 2.36 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.92 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.459 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 157.45 -20.55 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.161 179.665 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -63.84 110.64 4.01 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.069 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.43 166.89 25.65 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.399 2.066 . . . . 0.0 112.235 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.774 HD21 HD21 ' A' ' 34' ' ' LEU . 8.5 mt -94.71 123.25 38.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.977 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -68.2 156.86 89.06 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.934 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.33 -8.8 24.48 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.678 2.252 . . . . 0.0 112.512 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -89.48 12.01 17.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.395 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -98.89 14.23 29.74 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.711 0.291 . . . . 0.0 111.249 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 56.02 36.08 26.72 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.856 0.36 . . . . 0.0 111.064 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -82.56 90.45 6.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.902 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -138.62 -178.38 5.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.873 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.36 142.03 32.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.213 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.655 HD12 ' HB3' ' A' ' 53' ' ' TRP . 15.3 mt -83.62 -172.25 4.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.798 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.8 mmtt -116.57 163.12 16.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.975 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.82 -136.07 18.2 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.52 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.5 mmpt? -67.22 -18.24 65.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.566 0.222 . . . . 0.0 111.225 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.655 ' HB3' HD12 ' A' ' 49' ' ' LEU . 5.3 m-90 -96.45 31.93 2.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.741 0.305 . . . . 0.0 111.154 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 3.0 mttt -79.63 -51.38 1.19 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.911 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 23.7 Cg_exo -63.76 -11.81 28.46 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.514 2.143 . . . . 0.0 112.234 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.686 ' HD1' HD13 ' A' ' 70' ' ' LEU . 73.1 m-85 -105.17 171.87 7.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.813 0.339 . . . . 0.0 110.973 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.0 ttp85 -125.73 154.35 42.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.837 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.514 ' HB2' HD21 ' A' ' 49' ' ' LEU . 0.2 OUTLIER -117.79 162.22 18.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.054 -179.969 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.633 ' SG ' HD13 ' A' ' 40' ' ' LEU . 38.0 t -150.65 145.33 25.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.803 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.448 ' CE1' HD22 ' A' ' 66' ' ' LEU . 9.9 m170 -116.49 87.19 2.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.944 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.616 ' H ' HD12 ' A' ' 61' ' ' ILE . 5.3 mp -60.01 -28.28 40.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.936 0.398 . . . . 0.0 110.645 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.454 ' HB2' ' CD ' ' A' ' 63' ' ' PRO . 1.3 ptmm? -160.38 169.65 9.82 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.331 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.454 ' CD ' ' HB2' ' A' ' 62' ' ' LYS . 16.7 Cg_exo -67.93 5.8 0.99 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.697 2.264 . . . . 0.0 113.662 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -139.86 26.14 2.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.55 0.214 . . . . 0.0 111.326 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.815 ' O ' HD23 ' A' ' 66' ' ' LEU . 47.2 t -155.6 149.32 11.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.931 0.396 . . . . 0.0 111.506 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.815 HD23 ' O ' ' A' ' 65' ' ' VAL . 4.2 mt -146.82 117.33 7.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.663 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.675 HD22 ' N ' ' A' ' 68' ' ' VAL . 1.5 tm? -107.22 131.79 53.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.906 0.384 . . . . 0.0 111.189 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.675 ' N ' HD22 ' A' ' 67' ' ' LEU . 71.3 t -105.62 118.6 53.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.811 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.488 ' CD2' HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -133.64 -179.24 5.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.473 -179.296 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.686 HD13 ' HD1' ' A' ' 56' ' ' PHE . 7.2 tp -125.72 169.36 12.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.826 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.6 t -121.02 100.48 9.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.255 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.542 ' HD2' HG23 ' A' ' 77' ' ' ILE . 0.0 OUTLIER -75.85 163.63 27.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.549 179.926 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -43.18 -36.91 1.89 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.416 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -154.13 25.68 0.48 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.836 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 75.1 mt-10 -149.41 173.39 13.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.876 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.488 HD21 ' CD2' ' A' ' 69' ' ' TYR . 0.4 OUTLIER -128.53 144.61 51.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.5 179.593 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.55 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.0 pp -132.31 132.02 60.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.431 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.484 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 73.6 mt -80.62 125.92 30.61 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.643 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.558 HD11 ' CE1' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -87.74 -63.85 1.24 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.093 -179.759 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.526 ' O ' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -159.67 169.42 23.77 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.031 0.444 . . . . 0.0 111.381 179.775 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.889 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.2 tm? -119.79 141.06 49.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.75 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.889 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -157.03 -165.71 15.41 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.597 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 49.2 m -149.89 -175.48 5.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.787 0.327 . . . . 0.0 110.903 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 62.0 t-80 -68.51 -29.44 68.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.077 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.3 m -90.01 -23.67 21.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.187 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.11 -74.35 0.38 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.934 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 16.0 mt -68.39 -41.33 80.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.936 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.926 -179.958 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 tmm? . . . . . 0 N--CA 1.488 1.429 0 CA-C-O 120.84 0.352 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.8 mt -73.94 157.63 35.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.857 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.18 148.23 36.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.828 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.648 HD11 HD11 ' A' ' 78' ' ' LEU . 9.1 tt -121.56 154.88 36.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.981 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.731 ' HB2' HG22 ' A' ' 77' ' ' ILE . 5.4 t30 -140.4 171.23 14.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.79 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.9 mp -139.68 129.3 24.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.991 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.4 169.46 8.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.847 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -29.92 67.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.002 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.2 m -77.11 -56.52 4.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.008 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.437 ' CZ ' HD13 ' A' ' 78' ' ' LEU . 62.7 t80 -58.16 -33.58 69.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.048 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -61.26 -42.85 99.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.086 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.578 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 14.0 mttm -90.13 -16.59 29.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.565 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.405 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 1.8 m-20 -90.78 -11.17 40.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.496 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.652 ' O ' HD13 ' A' ' 18' ' ' LEU . 25.4 t80 -90.84 -67.56 0.84 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.206 -179.596 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.789 ' HA ' HD22 ' A' ' 18' ' ' LEU . 28.4 t0 -90.84 -33.13 15.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.312 -0.404 . . . . 0.0 112.082 -179.313 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.578 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 2.9 mttt -74.53 -28.04 60.8 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.948 -179.418 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.405 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 30.6 tp -70.92 -35.77 72.39 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.159 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.789 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.1 OUTLIER -57.99 -33.17 68.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.66 179.812 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 mt -90.05 -6.86 55.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.435 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -96.07 27.15 3.77 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.713 0.292 . . . . 0.0 111.215 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.71 23.03 19.5 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.73 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.46 ' CD1' HD12 ' A' ' 18' ' ' LEU . 11.8 t80 -116.61 122.99 46.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.871 0.367 . . . . 0.0 110.774 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.424 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 14.6 t0 -66.65 128.84 37.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.898 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.862 ' HA ' HD23 ' A' ' 27' ' ' LEU . 7.8 p-10 -78.1 -3.2 41.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.517 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.2 t -82.15 -27.32 32.8 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.685 0.279 . . . . 0.0 111.106 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.3 t -80.57 -36.65 16.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.439 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.862 HD23 ' HA ' ' A' ' 24' ' ' ASP . 2.0 pp -57.1 -37.37 71.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.056 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -57.76 -24.09 55.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.204 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -78.61 -35.37 45.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.112 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.742 HG21 HG11 ' A' ' 65' ' ' VAL . 11.5 p -90.1 -43.49 14.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.226 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.583 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -58.39 -33.04 46.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.772 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.738 HD23 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -60.06 -56.64 19.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.641 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.738 ' N ' HD23 ' A' ' 32' ' ' LEU . 85.0 m -55.59 -24.05 30.69 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.378 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.547 HD12 ' HA ' ' A' ' 31' ' ' ILE . 16.1 mt -86.61 -34.4 19.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.759 0.314 . . . . 0.0 111.214 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -103.75 20.15 18.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.436 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.444 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 0.7 OUTLIER -116.14 21.12 13.93 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 -179.708 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.405 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 4.4 ptmm? 44.01 31.23 0.49 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.481 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -93.86 135.44 24.88 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.897 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -74.84 138.07 22.96 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.499 2.133 . . . . 0.0 112.284 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 33.4 mt -90.2 125.44 35.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.797 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -69.22 155.25 93.93 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.839 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -68.68 -10.24 28.5 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.557 2.171 . . . . 0.0 112.532 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.3 7.5 25.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.438 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -92.98 13.91 19.26 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.599 0.238 . . . . 0.0 111.229 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 58.04 41.23 24.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.88 0.371 . . . . 0.0 111.041 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -86.93 111.79 21.16 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.98 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 11.7 m80 -164.72 -178.35 5.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.907 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -87.18 156.47 19.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.083 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.482 HD11 ' CD ' ' A' ' 58' ' ' GLU . 78.0 mt -109.02 176.92 4.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.934 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -124.8 152.65 43.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.876 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 60.91 111.11 0.01 OUTLIER Glycine 0 CA--C 1.508 -0.37 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.531 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 70.38 -44.27 0.57 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.748 0.309 . . . . 0.0 110.878 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 3.4 m0 -104.55 36.24 2.48 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.9 0.381 . . . . 0.0 110.915 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.445 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.1 OUTLIER -74.54 -49.95 4.76 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.159 -179.949 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.445 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 96.0 Cg_endo -84.7 28.99 0.55 Allowed 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.704 2.27 . . . . 0.0 113.018 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.402 ' CD1' ' O ' ' A' ' 55' ' ' PRO . 24.2 m-85 -139.8 170.42 15.92 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.742 0.306 . . . . 0.0 110.832 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.441 ' O ' HG13 ' A' ' 68' ' ' VAL . 24.6 ttm180 -128.73 139.24 52.31 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.996 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.482 ' CD ' HD11 ' A' ' 49' ' ' LEU . 0.8 OUTLIER -97.61 173.19 7.26 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.804 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -169.55 109.95 0.44 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.834 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.416 ' CD2' HD22 ' A' ' 66' ' ' LEU . 9.0 m170 -87.15 78.42 8.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.853 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.671 HD11 ' HB3' ' A' ' 67' ' ' LEU . 3.4 mp -58.26 -50.97 76.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.034 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.504 ' HD3' HG22 ' A' ' 61' ' ' ILE . 2.3 mmmt -115.98 171.73 4.4 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.729 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.428 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 14.3 Cg_exo -68.81 -2.19 9.02 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.681 2.254 . . . . 0.0 112.947 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -145.85 29.49 1.1 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.823 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.804 ' O ' HD23 ' A' ' 66' ' ' LEU . 47.9 t -139.47 147.39 24.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.217 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.804 HD23 ' O ' ' A' ' 65' ' ' VAL . 2.0 mt -147.35 92.15 2.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.777 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.671 ' HB3' HD11 ' A' ' 61' ' ' ILE . 3.3 tm? -85.15 131.78 34.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.979 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.643 ' N ' HD13 ' A' ' 67' ' ' LEU . 96.9 t -109.84 116.05 51.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.042 179.046 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.599 ' CE2' HD11 ' A' ' 76' ' ' LEU . 21.7 p90 -134.33 156.35 48.62 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.233 -179.291 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.782 ' HB2' HD11 ' A' ' 77' ' ' ILE . 4.3 tp -111.74 -179.79 3.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.891 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.0 t -130.34 108.12 15.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.095 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.68 173.89 6.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.869 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -59.59 102.78 0.16 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.888 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 55.78 25.53 8.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.101 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 84.8 mt-10 -153.43 130.34 10.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.855 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.599 HD11 ' CE2' ' A' ' 69' ' ' TYR . 0.5 OUTLIER -97.31 142.64 28.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.77 179.862 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.782 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.2 pp -129.26 136.29 59.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.305 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.648 HD11 HD11 ' A' ' 4' ' ' LEU . 70.6 mt -87.73 132.23 34.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.645 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.74 -61.29 1.75 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.093 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.409 ' NH2' HG21 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -172.99 162.89 4.72 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.921 0.391 . . . . 0.0 111.358 -179.982 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.569 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.5 tm? -115.36 131.25 56.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.845 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.569 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -139.15 -162.08 8.98 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.498 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 95.7 p -147.8 169.62 19.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.865 0.364 . . . . 0.0 110.819 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -59.42 -28.95 67.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.962 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 18.4 m -90.11 -20.97 22.51 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.183 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -88.52 -75.0 0.44 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.09 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.703 HD12 ' HB2' ' A' ' 66' ' ' LEU . 46.2 mt -56.97 -41.99 79.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.227 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.255 -0.879 . . . . 0.0 111.025 179.998 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.9 ttp . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.708 0.289 . . . . 0.0 111.504 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 11.6 mt -135.02 162.89 31.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.838 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.82 138.29 58.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.829 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.416 HD23 ' N ' ' A' ' 5' ' ' ASN . 8.5 tt -116.0 154.68 29.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.927 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.709 ' HB2' HG22 ' A' ' 77' ' ' ILE . 6.6 t30 -135.8 172.41 13.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.827 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.4 mp -139.7 123.13 17.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.918 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -98.55 160.25 14.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.8 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.8 tttp -59.72 -34.87 73.47 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.884 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.38 -25.08 63.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.026 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.404 ' HA ' ' OD2' ' A' ' 13' ' ' ASP . 36.1 t80 -85.34 -33.9 21.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.979 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -58.73 -31.63 68.48 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.086 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.458 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 11.0 mtpp -90.34 -5.23 56.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.857 -179.597 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.457 ' HB2' ' HB3' ' A' ' 81' ' ' LEU . 17.1 p30 -90.69 -17.46 26.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.808 0.337 . . . . 0.0 111.466 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.802 ' CE2' HD13 ' A' ' 27' ' ' LEU . 30.2 t80 -91.18 -66.77 0.9 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.309 -179.537 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -91.3 -43.02 10.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.032 -179.215 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.458 ' HB3' ' O ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -71.24 -16.73 62.51 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.675 0.25 . . . . 0.0 111.675 -178.949 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.442 ' HB2' ' C ' ' A' ' 13' ' ' ASP . 1.5 tt -80.29 -36.89 33.75 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.014 0.435 . . . . 0.0 110.014 179.3 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.717 HD13 ' HB3' ' A' ' 24' ' ' ASP . 0.4 OUTLIER -66.8 -42.65 85.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.785 179.707 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.9 mt -60.55 -41.0 93.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.888 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -57.82 -27.53 63.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.911 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.96 39.89 0.21 Allowed Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.537 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.426 ' CG ' HD22 ' A' ' 17' ' ' LEU . 76.4 t80 -119.75 154.09 34.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.815 0.34 . . . . 0.0 110.823 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.43 ' O ' HG12 ' A' ' 26' ' ' VAL . 5.6 t0 -68.29 132.27 46.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.922 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.717 ' HB3' HD13 ' A' ' 18' ' ' LEU . 5.5 p-10 -90.64 -26.28 19.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.024 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.8 m -68.52 -32.13 71.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.319 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.43 HG12 ' O ' ' A' ' 23' ' ' ASP . 14.1 p -67.85 -30.92 50.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.412 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.802 HD13 ' CE2' ' A' ' 14' ' ' PHE . 1.0 OUTLIER -63.88 -36.66 84.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.021 -179.839 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -64.38 -18.82 65.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.221 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -86.95 -36.71 18.16 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.094 -179.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.766 HG13 HD12 ' A' ' 31' ' ' ILE . 13.3 p -86.05 -47.8 16.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.369 -179.768 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.766 HD12 HG13 ' A' ' 30' ' ' VAL . 1.7 mp -59.58 -40.12 81.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.958 0.408 . . . . 0.0 110.105 179.542 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.833 HD23 ' N ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -52.21 -62.9 1.34 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.804 179.78 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.833 ' N ' HD23 ' A' ' 32' ' ' LEU . 99.3 m -51.59 -41.0 60.87 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.788 0.328 . . . . 0.0 111.139 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 78.9 mt -59.2 -36.22 74.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.71 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.414 ' HB3' ' NH1' ' A' ' 35' ' ' ARG . 3.0 mtm105 -104.18 19.99 19.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.239 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.452 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 1.4 mmpt? -108.58 15.5 23.72 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.547 0.213 . . . . 0.0 111.496 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.6 mtmt 59.43 21.52 9.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.68 0.276 . . . . 0.0 110.604 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -89.36 110.76 41.14 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.15 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.62 115.03 4.18 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.445 2.097 . . . . 0.0 112.276 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.501 HD13 ' SG ' ' A' ' 59' ' ' CYS . 3.4 mt -61.39 140.62 58.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.89 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -74.09 154.59 88.56 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.894 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.21 -12.49 35.78 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.618 2.212 . . . . 0.0 112.499 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -87.22 8.89 22.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.409 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -90.49 10.07 26.77 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.695 -0.229 . . . . 0.0 111.218 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 64.19 41.7 5.98 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.912 0.387 . . . . 0.0 110.971 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -87.88 79.71 8.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.903 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -139.66 -179.81 6.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.838 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -81.17 123.58 28.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.185 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.438 HD11 ' CG ' ' A' ' 58' ' ' GLU . 10.2 mt -72.21 -177.52 2.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.846 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.2 mttt -125.25 171.14 10.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.802 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.03 -131.27 11.64 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.467 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 19.8 mttt -63.74 -31.45 72.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.719 0.295 . . . . 0.0 110.868 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -97.5 38.97 1.22 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.96 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.439 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 19.4 mttt -73.28 -50.31 6.45 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.09 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.439 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 4.7 Cg_exo -79.81 44.84 1.8 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.883 2.389 . . . . 0.0 112.464 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.404 ' CG ' ' O ' ' A' ' 55' ' ' PRO . 82.6 m-85 -156.7 178.29 10.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.831 0.348 . . . . 0.0 110.953 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.521 ' O ' HG13 ' A' ' 68' ' ' VAL . 0.1 OUTLIER -132.85 131.37 40.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.841 179.968 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.438 ' CG ' HD11 ' A' ' 49' ' ' LEU . 1.8 tt0 -95.99 171.33 8.69 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.938 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.501 ' SG ' HD13 ' A' ' 40' ' ' LEU . 11.5 t -171.02 118.8 0.49 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.817 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.51 ' CD2' HD22 ' A' ' 66' ' ' LEU . 1.0 OUTLIER -93.3 99.98 12.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.937 -179.905 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.589 ' H ' HD12 ' A' ' 61' ' ' ILE . 4.8 mp -70.42 -53.65 21.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.904 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.445 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 0.1 OUTLIER -112.64 172.25 3.68 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.49 179.757 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.445 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 18.1 Cg_exo -65.99 -4.6 10.48 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.51 2.14 . . . . 0.0 112.931 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -143.59 28.46 1.46 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.029 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.736 HG11 HG21 ' A' ' 30' ' ' VAL . 58.4 t -140.46 143.46 29.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.334 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.758 HD12 HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -159.12 111.05 2.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.792 179.742 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.59 HD12 ' O ' ' A' ' 68' ' ' VAL . 0.1 OUTLIER -113.48 134.45 54.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.865 -179.885 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.59 ' O ' HD12 ' A' ' 67' ' ' LEU . 21.7 t -91.88 145.91 6.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.92 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 51.7 p90 -156.17 160.13 39.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.987 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.694 ' HB2' HD11 ' A' ' 77' ' ' ILE . 2.6 tp -109.32 161.24 15.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.824 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.9 t -120.92 100.62 9.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.084 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.56 166.32 23.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.817 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -40.45 -32.25 0.19 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.596 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -167.35 37.7 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.829 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -160.51 102.84 1.38 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.106 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.439 ' C ' HD23 ' A' ' 76' ' ' LEU . 10.5 tt -67.92 134.96 51.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.66 179.747 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.709 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.2 pp -126.37 128.65 71.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.333 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 82.5 mt -74.27 149.2 40.86 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.546 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -109.81 -71.03 0.78 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.261 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.59 159.21 36.84 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.163 0.506 . . . . 0.0 111.106 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.802 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.9 tm? -113.79 136.78 52.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.535 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.802 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -157.46 173.33 34.91 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.654 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.5 m -108.73 170.27 8.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.839 0.352 . . . . 0.0 110.868 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 4.0 t-80 -59.09 -26.72 64.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.059 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.7 t -83.79 -27.51 28.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.136 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -81.29 -69.74 0.59 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.022 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.758 HD12 HD12 ' A' ' 66' ' ' LEU . 35.1 mt -67.6 -37.87 83.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.002 -179.82 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.207 -0.901 . . . . 0.0 110.892 -179.982 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.3 mtp . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.78 0.324 . . . . 0.0 111.234 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.685 HD12 ' HB2' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -109.79 154.42 23.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.922 179.959 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.52 146.62 39.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.979 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.418 HD11 HD11 ' A' ' 78' ' ' LEU . 7.3 tt -122.01 152.33 39.87 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.861 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.743 ' HB2' HG22 ' A' ' 77' ' ' ILE . 1.8 t30 -138.88 171.36 14.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.937 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.0 mp -147.12 116.69 7.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.919 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -79.82 171.14 15.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.851 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.3 ttpt -60.71 -31.24 70.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.942 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.1 m -72.99 -50.22 24.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.884 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -59.96 -35.7 75.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.812 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -63.41 -37.28 86.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.955 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.561 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 4.7 mmtt -89.16 -22.86 22.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.084 0.468 . . . . 0.0 111.097 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.442 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 4.9 m-20 -90.95 -11.11 40.01 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.232 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.637 ' O ' HD13 ' A' ' 18' ' ' LEU . 29.3 t80 -90.86 -67.38 0.85 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.833 0.349 . . . . 0.0 111.367 -179.558 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.821 ' HA ' HD22 ' A' ' 18' ' ' LEU . 49.6 m-20 -91.09 -33.26 15.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.193 -179.18 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.561 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 12.6 mmtt -76.69 -26.79 55.13 Favored 'General case' 0 C--N 1.334 -0.096 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.161 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.442 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 29.2 tp -71.8 -33.01 68.19 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.185 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.821 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.1 OUTLIER -57.16 -33.58 67.56 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.821 179.967 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.7 mt -89.91 -3.32 58.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.454 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -97.7 26.81 4.77 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.669 0.271 . . . . 0.0 110.995 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 93.26 23.07 25.5 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.786 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.498 ' CD1' HD12 ' A' ' 18' ' ' LEU . 13.0 t80 -110.26 144.19 39.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.834 0.349 . . . . 0.0 110.797 179.768 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.419 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 5.1 t0 -99.61 113.4 25.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.004 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -58.1 -21.03 44.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.424 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.4 m -50.28 -54.43 21.34 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.775 0.322 . . . . 0.0 111.206 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.4 t -68.6 -34.62 66.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.984 0.421 . . . . 0.0 111.156 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.566 HD22 HD11 ' A' ' 18' ' ' LEU . 6.8 tp -65.56 -33.57 76.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.702 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -56.54 -57.92 10.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.128 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.558 ' HA ' HD22 ' A' ' 32' ' ' LEU . 4.6 mt-10 -50.5 -25.78 4.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.466 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.658 HG13 HG21 ' A' ' 61' ' ' ILE . 58.0 t -80.98 -68.25 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.911 0.386 . . . . 0.0 111.573 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.532 HD13 ' CD1' ' A' ' 27' ' ' LEU . 1.1 mp -51.38 -46.33 34.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.842 -179.286 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.832 HD23 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -55.96 -24.6 39.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.645 0.26 . . . . 0.0 111.314 -179.579 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.832 ' N ' HD23 ' A' ' 32' ' ' LEU . 27.4 m -82.11 -30.43 31.17 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.053 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.78 HD21 HD21 ' A' ' 40' ' ' LEU . 3.0 mt -90.13 -28.57 18.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.459 -179.634 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.401 ' HB3' ' NH1' ' A' ' 35' ' ' ARG . 14.0 mtm105 -94.16 20.11 8.43 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.692 -179.535 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.466 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 4.2 mttt -118.19 -55.72 2.22 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.142 -0.223 . . . . 0.0 110.946 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.466 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 7.3 pttt 156.12 -20.53 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.965 179.521 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -59.44 111.47 3.84 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.955 -179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 158.73 56.03 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.368 2.046 . . . . 0.0 112.164 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.78 HD21 HD21 ' A' ' 34' ' ' LEU . 13.0 mt -82.64 116.03 21.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.905 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.405 ' HB2' ' CE2' ' A' ' 44' ' ' PHE . 83.3 m-20 -62.66 158.4 51.26 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.956 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.47 -11.33 30.97 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.626 2.217 . . . . 0.0 112.505 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.08 17.21 11.23 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.203 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.405 ' CE2' ' HB2' ' A' ' 41' ' ' ASP . 19.6 m-85 -98.04 6.67 47.36 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.261 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 44.5 mm-40 64.8 41.61 4.95 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.848 0.356 . . . . 0.0 110.889 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -86.62 90.4 8.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.933 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 70.2 m-70 -136.67 173.16 12.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.982 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.07 158.01 32.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.156 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.74 HD21 ' CD ' ' A' ' 58' ' ' GLU . 1.8 mp -112.07 -175.43 2.69 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.832 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.3 mttm -124.04 167.68 13.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.909 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 77.29 -133.27 13.02 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.497 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 10.8 mptt -60.45 -31.66 70.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.78 0.324 . . . . 0.0 110.854 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 17.1 m95 -98.63 38.69 1.33 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.973 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.5 -53.73 16.24 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.953 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.415 ' HG2' ' CE1' ' A' ' 56' ' ' PHE . 93.8 Cg_endo -84.94 34.62 0.51 Allowed 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.644 2.229 . . . . 0.0 112.609 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.463 ' HE2' HD21 ' A' ' 79' ' ' LEU . 81.3 m-85 -132.25 -175.45 3.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.878 0.371 . . . . 0.0 110.879 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.11 137.59 36.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.857 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.74 ' CD ' HD21 ' A' ' 49' ' ' LEU . 2.1 tt0 -98.66 171.33 8.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.819 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.476 ' SG ' HD13 ' A' ' 40' ' ' LEU . 9.7 t -167.08 111.88 0.74 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.875 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.63 ' CE1' HD22 ' A' ' 66' ' ' LEU . 10.6 m170 -90.5 82.78 5.84 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.898 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.658 HG21 HG13 ' A' ' 30' ' ' VAL . 3.5 mp -56.13 -31.72 32.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.85 0.357 . . . . 0.0 110.93 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.529 ' HB2' HG23 ' A' ' 65' ' ' VAL . 0.0 OUTLIER -130.59 170.38 11.28 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.653 179.932 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.42 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 11.5 Cg_exo -70.75 0.96 5.59 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.852 2.368 . . . . 0.0 112.952 -179.667 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -147.27 27.46 1.03 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.788 0.328 . . . . 0.0 110.831 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.832 ' O ' HD23 ' A' ' 66' ' ' LEU . 40.6 t -135.26 152.58 32.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.08 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.832 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.8 OUTLIER -146.98 104.2 3.67 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.693 179.771 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.632 ' HB3' HD11 ' A' ' 61' ' ' ILE . 4.2 tp -104.95 121.75 44.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.034 -179.66 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.626 ' N ' HD12 ' A' ' 67' ' ' LEU . 46.3 t -99.08 135.93 32.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.794 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.458 ' CD1' HD11 ' A' ' 76' ' ' LEU . 46.4 p90 -153.3 161.97 41.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.051 -179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.743 ' O ' HD12 ' A' ' 76' ' ' LEU . 5.4 tp -109.96 169.06 8.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.777 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.1 t -127.34 106.66 15.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.133 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.43 163.34 21.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.675 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -43.62 -40.82 4.29 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.467 -179.759 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -150.04 29.25 0.73 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.897 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -151.26 151.67 32.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.828 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.743 HD12 ' O ' ' A' ' 70' ' ' LEU . 37.5 tp -115.09 137.14 52.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.691 179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.743 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.0 pp -130.76 131.3 64.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.275 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.418 HD11 HD11 ' A' ' 4' ' ' LEU . 41.2 mt -82.66 136.9 34.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.788 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.463 HD21 ' HE2' ' A' ' 56' ' ' PHE . 0.3 OUTLIER -92.29 -71.29 0.65 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.982 -179.782 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.417 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -157.42 165.6 35.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.138 -179.957 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.578 ' C ' HD13 ' A' ' 81' ' ' LEU . 3.4 tm? -122.4 123.51 41.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.806 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -138.24 -169.59 11.63 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.416 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -140.29 -178.25 5.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.79 0.328 . . . . 0.0 110.865 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 5.6 t-80 -67.99 -28.71 67.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.032 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 17.9 m -89.95 -26.9 20.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.067 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.81 -68.6 0.68 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.048 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.658 HD12 ' HB2' ' A' ' 66' ' ' LEU . 16.6 mt -71.75 -38.6 70.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.068 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.903 -179.982 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.4 mmm . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.8 0.333 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.1 mt 61.08 165.99 0.09 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.88 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.4 ' HB2' ' HG3' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -59.02 150.44 24.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.859 179.946 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.628 HD11 HD11 ' A' ' 78' ' ' LEU . 8.6 tt -116.09 144.84 43.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.086 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.84 ' HB2' HG22 ' A' ' 77' ' ' ILE . 0.1 OUTLIER -133.67 -173.03 3.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.804 179.884 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.569 ' H ' HD21 ' A' ' 5' ' ' ASN . 3.9 mp -143.91 140.77 29.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.96 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.8 165.58 11.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.819 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.84 -31.33 70.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.795 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.0 t -74.62 -47.8 30.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.941 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.43 ' CE2' HD13 ' A' ' 78' ' ' LEU . 30.5 t80 -59.53 -38.04 79.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.934 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -60.71 -35.11 75.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.931 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.569 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 7.3 mtmp? -85.94 -20.0 29.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.147 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -90.59 -11.51 39.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.282 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.683 ' O ' HD13 ' A' ' 18' ' ' LEU . 46.0 t80 -90.57 -66.97 0.88 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.225 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.82 ' HA ' HD22 ' A' ' 18' ' ' LEU . 7.8 m-20 -90.96 -32.17 16.06 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.084 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.569 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -77.34 -27.29 52.67 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.263 -179.106 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.453 ' O ' ' HB3' ' A' ' 22' ' ' PHE . 1.1 tt -73.42 -33.62 65.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.936 0.398 . . . . 0.0 109.974 179.447 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.82 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.2 OUTLIER -54.91 -42.58 72.36 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.111 -179.983 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 85.8 mt -82.88 -3.26 56.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.543 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.96 37.44 1.31 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.853 0.359 . . . . 0.0 110.983 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 82.86 25.65 48.67 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.387 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.471 ' CD1' HD12 ' A' ' 18' ' ' LEU . 8.9 t80 -116.35 132.18 56.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.755 0.312 . . . . 0.0 110.782 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.403 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 13.5 t0 -87.34 124.11 33.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.907 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.841 ' HA ' HD23 ' A' ' 27' ' ' LEU . 11.5 p-10 -55.96 -27.43 52.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.069 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 72.7 m -57.09 -22.77 42.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.174 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.433 ' HB ' ' CZ ' ' A' ' 22' ' ' PHE . 27.1 t -83.64 -45.65 18.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.312 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.841 HD23 ' HA ' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -59.09 -35.64 73.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.905 -179.798 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.29 -26.75 61.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.859 179.832 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -73.89 -45.36 51.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.881 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.582 HG23 ' CG1' ' A' ' 61' ' ' ILE . 9.2 p -78.74 -47.99 22.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.274 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.498 ' N ' HG13 ' A' ' 30' ' ' VAL . 1.4 mp -50.08 -35.95 11.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.928 0.394 . . . . 0.0 110.413 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.806 HD23 ' N ' ' A' ' 33' ' ' THR . 1.0 OUTLIER -52.76 -62.6 1.54 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.419 179.448 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.806 ' N ' HD23 ' A' ' 32' ' ' LEU . 72.3 m -51.41 -25.74 6.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.552 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 18.8 mt -73.58 -66.54 0.68 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.789 0.328 . . . . 0.0 110.933 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.6 mtt180 -60.21 -52.0 67.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.78 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.704 ' HE2' HD21 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -68.16 -14.31 62.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.405 179.849 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.528 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 3.0 ptmt 51.96 69.17 0.7 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.583 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.738 ' HB3' HG23 ' A' ' 33' ' ' THR . 7.2 tt0 -79.18 136.17 57.42 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.601 179.413 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.93 104.81 0.2 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.423 2.082 . . . . 0.0 112.104 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 64.0 mt -67.47 127.76 33.89 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.009 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -80.89 157.93 71.01 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.841 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -64.49 -26.97 62.24 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 122.505 2.137 . . . . 0.0 112.239 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -62.24 -23.71 66.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.033 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -62.52 -18.48 62.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.172 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 63.82 41.76 6.59 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.822 0.344 . . . . 0.0 110.983 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -77.39 87.32 3.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.766 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -134.65 -177.67 4.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.934 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -90.43 124.2 34.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.209 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.714 HD11 ' CD ' ' A' ' 58' ' ' GLU . 15.6 mt -68.47 -177.38 0.92 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.796 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.0 mmtp -125.12 156.98 37.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.917 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 78.88 -116.85 4.43 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.552 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.9 tppt? -61.18 -30.23 70.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.742 0.306 . . . . 0.0 111.098 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.433 ' CE3' HD13 ' A' ' 49' ' ' LEU . 5.5 m-90 -114.41 47.88 1.18 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.937 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 1.4 tttt -79.59 -50.99 1.23 Allowed Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.256 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 83.4 Cg_endo -82.35 11.21 3.25 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.534 2.156 . . . . 0.0 112.853 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.497 ' CD1' HD21 ' A' ' 79' ' ' LEU . 95.6 m-85 -118.49 174.65 6.13 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.759 0.314 . . . . 0.0 110.972 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -125.42 127.15 46.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.952 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.714 ' CD ' HD11 ' A' ' 49' ' ' LEU . 2.7 tt0 -95.98 156.38 16.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.742 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 16.5 t -160.02 131.97 6.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.785 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.4 m170 -111.04 90.83 3.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.964 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.582 ' CG1' HG23 ' A' ' 30' ' ' VAL . 4.0 mp -55.4 -24.64 16.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.716 179.657 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.444 ' HB2' ' CD ' ' A' ' 63' ' ' PRO . 1.6 ptmt -155.15 169.82 9.67 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.392 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.444 ' CD ' ' HB2' ' A' ' 62' ' ' LYS . 16.3 Cg_exo -68.26 3.79 1.92 Allowed 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.688 2.259 . . . . 0.0 113.325 -179.463 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -138.31 30.38 2.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.703 0.287 . . . . 0.0 111.225 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.794 ' O ' HD23 ' A' ' 66' ' ' LEU . 79.3 t -155.38 153.56 7.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.91 0.386 . . . . 0.0 111.244 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.794 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.2 OUTLIER -150.34 86.91 1.42 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.481 179.657 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.461 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 4.3 tp -85.47 109.05 18.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.948 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.54 ' CG1' HD22 ' A' ' 79' ' ' LEU . 57.4 t -84.61 135.26 25.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.669 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -143.25 155.03 44.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.97 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.719 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.5 OUTLIER -106.29 147.3 29.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.891 -179.879 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.747 ' HA ' HD12 ' A' ' 76' ' ' LEU . 26.4 t -101.54 116.69 45.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.155 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.62 162.76 14.04 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.791 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -44.19 -48.89 9.3 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.594 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -139.24 29.66 2.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.971 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.4 ' HG3' ' HB2' ' A' ' 3' ' ' LYS . 15.6 mp0 -160.35 171.41 19.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.72 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.747 HD12 ' HA ' ' A' ' 71' ' ' VAL . 7.6 tp -130.9 148.59 52.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.785 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.84 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.1 pp -135.27 137.89 49.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.33 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.628 HD11 HD11 ' A' ' 4' ' ' LEU . 76.0 mt -81.68 133.58 35.37 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.651 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.54 HD22 ' CG1' ' A' ' 68' ' ' VAL . 0.3 OUTLIER -88.93 -70.42 0.65 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.972 -179.753 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.471 ' HD2' HD21 ' A' ' 87' ' ' LEU . 0.1 OUTLIER -158.1 179.44 9.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.223 -179.901 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.587 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.1 tm? -132.93 128.22 36.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.742 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.587 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -166.83 168.63 40.35 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.591 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.46 ' C ' HD11 ' A' ' 66' ' ' LEU . 87.9 p -109.82 177.5 4.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.869 0.366 . . . . 0.0 110.71 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.496 ' N ' HD11 ' A' ' 66' ' ' LEU . 14.7 t-80 -60.72 -26.69 67.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.007 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.44 -28.76 52.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.042 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -89.77 -71.82 0.59 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.022 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.471 HD21 ' HD2' ' A' ' 80' ' ' ARG . 29.0 mt -58.44 -42.94 88.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.04 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.833 179.971 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.836 0.351 . . . . 0.0 111.166 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.4 mt 60.83 -179.2 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.963 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -104.28 151.51 23.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.894 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.608 HD21 HD11 ' A' ' 78' ' ' LEU . 5.7 tp -117.89 143.36 46.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.869 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.748 ' HB2' HG22 ' A' ' 77' ' ' ILE . 2.3 t30 -130.06 171.69 12.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.878 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.2 mp -135.51 115.35 13.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.838 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.2 mmtm -82.9 169.59 15.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.772 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.0 tttt -59.94 -31.06 69.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.891 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.1 m -73.37 -46.4 49.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.888 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -61.02 -29.95 70.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.896 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -59.22 -53.72 55.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.939 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.483 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 0.6 OUTLIER -78.33 -16.69 57.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.02 0.438 . . . . 0.0 111.31 -179.961 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.44 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 8.4 m-20 -90.52 -17.71 26.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.886 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.56 ' O ' HD13 ' A' ' 18' ' ' LEU . 76.9 t80 -90.94 -68.34 0.8 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.335 -179.627 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.803 ' HA ' HD22 ' A' ' 18' ' ' LEU . 15.3 m-20 -90.82 -41.57 11.14 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -178.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.483 ' HB3' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -69.96 -23.92 63.25 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.205 -179.014 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.44 ' HB2' ' HA ' ' A' ' 13' ' ' ASP . 25.7 tp -73.07 -35.6 66.69 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.803 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.1 OUTLIER -58.08 -43.44 87.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.854 179.855 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 20.2 mt -79.81 -4.69 53.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.393 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.69 22.85 7.59 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.759 0.314 . . . . 0.0 111.153 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 96.78 23.04 16.48 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.823 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.499 ' CD1' HD12 ' A' ' 18' ' ' LEU . 11.1 t80 -114.19 137.45 51.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.813 0.34 . . . . 0.0 110.839 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.424 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 1.9 t0 -92.68 119.65 32.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.033 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -59.17 -19.01 41.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.473 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.4 p -46.82 -49.08 20.59 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 120.698 0.285 . . . . 0.0 111.309 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.459 HG13 ' HD2' ' A' ' 62' ' ' LYS . 21.7 t -74.53 -34.61 35.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.985 0.422 . . . . 0.0 111.111 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.68 ' CD1' HD13 ' A' ' 31' ' ' ILE . 5.6 tp -64.72 -39.01 92.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.722 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -54.85 -41.94 71.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.18 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.546 ' C ' HD22 ' A' ' 32' ' ' LEU . 3.5 mt-10 -69.8 -12.22 61.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.393 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.424 HG13 HD13 ' A' ' 61' ' ' ILE . 77.7 t -90.43 -70.94 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.847 0.356 . . . . 0.0 111.693 -179.701 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.68 HD13 ' CD1' ' A' ' 27' ' ' LEU . 1.4 mp -49.46 -40.0 14.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.036 -179.067 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.764 HD23 ' N ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -62.4 -14.63 42.47 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.369 -179.669 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.764 ' N ' HD23 ' A' ' 32' ' ' LEU . 92.9 m -90.08 -30.11 17.91 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.744 0.307 . . . . 0.0 110.866 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.9 mt -88.64 -31.63 18.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.398 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 31.8 mtm180 -93.21 20.21 7.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.338 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.464 ' O ' ' CG ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -123.47 24.46 8.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.831 0.348 . . . . 0.0 111.341 -179.821 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.464 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 3.9 pttp 46.71 47.21 15.01 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.319 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -123.82 109.89 29.9 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.786 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -66.35 135.75 40.88 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.396 2.064 . . . . 0.0 112.238 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.43 HD13 ' SG ' ' A' ' 59' ' ' CYS . 1.7 mt -64.03 -178.99 0.37 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.847 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.07 160.49 38.87 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.909 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.53 -18.34 48.85 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.601 2.201 . . . . 0.0 112.438 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.59 -1.64 38.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.523 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.445 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.3 m-85 -78.41 -3.01 41.12 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.61 0.243 . . . . 0.0 111.401 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 62.39 43.62 7.96 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.883 0.373 . . . . 0.0 110.866 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -88.43 100.46 13.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.907 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 75.7 m80 -133.22 173.37 11.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.95 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -81.09 131.86 35.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.072 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.763 HD11 ' HG3' ' A' ' 58' ' ' GLU . 7.1 mt -81.21 -178.78 7.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.875 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.21 157.09 41.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.879 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.42 ' C ' ' H ' ' A' ' 53' ' ' TRP . . . 60.31 109.93 0.01 OUTLIER Glycine 0 CA--C 1.508 -0.402 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.516 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 70.22 -44.87 0.58 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.667 0.27 . . . . 0.0 110.966 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.42 ' H ' ' C ' ' A' ' 51' ' ' GLY . 8.3 m95 -105.09 35.7 2.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.881 0.372 . . . . 0.0 110.887 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.456 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.1 OUTLIER -68.21 -52.82 20.86 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.141 179.975 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.456 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 71.6 Cg_endo -77.79 4.51 6.01 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.435 2.09 . . . . 0.0 112.699 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.782 ' CD2' HD13 ' A' ' 70' ' ' LEU . 30.6 m-85 -104.0 172.62 6.7 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.832 0.348 . . . . 0.0 110.806 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 57.1 ttm-85 -133.03 137.6 46.51 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.918 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.763 ' HG3' HD11 ' A' ' 49' ' ' LEU . 0.8 OUTLIER -98.96 172.32 7.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.863 -179.959 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.43 ' SG ' HD13 ' A' ' 40' ' ' LEU . 17.7 t -166.13 129.47 2.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.76 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.47 ' CE1' HD22 ' A' ' 66' ' ' LEU . 2.5 m-70 -99.52 84.38 2.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.067 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.672 HD11 ' HB3' ' A' ' 67' ' ' LEU . 2.9 mp -58.17 -28.32 34.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.031 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.459 ' HD2' HG13 ' A' ' 26' ' ' VAL . 14.7 mttt -137.34 168.26 17.32 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.658 -179.86 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.404 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 42.5 Cg_endo -67.61 -3.19 9.77 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.397 2.065 . . . . 0.0 112.824 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -145.04 28.6 1.23 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.656 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.901 ' O ' HD23 ' A' ' 66' ' ' LEU . 51.8 t -137.73 145.79 28.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.282 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.901 HD23 ' O ' ' A' ' 65' ' ' VAL . 6.7 mt -140.32 119.78 13.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.547 179.392 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.697 HD12 ' N ' ' A' ' 68' ' ' VAL . 4.8 tp -116.16 127.88 55.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.227 -179.489 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.697 ' N ' HD12 ' A' ' 67' ' ' LEU . 46.0 t -103.97 138.09 29.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.479 179.489 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.45 ' CD1' HD11 ' A' ' 76' ' ' LEU . 46.0 p90 -151.78 164.77 36.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.914 0.387 . . . . 0.0 110.993 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.782 HD13 ' CD2' ' A' ' 56' ' ' PHE . 4.3 tp -114.37 179.69 3.88 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.851 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.6 t -122.07 111.47 30.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.03 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.32 168.29 9.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.962 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -62.05 106.47 0.72 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.846 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.3 t0 58.4 21.6 8.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.103 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -156.6 147.79 22.19 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.85 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.45 HD11 ' CD1' ' A' ' 69' ' ' TYR . 7.2 tt -111.97 147.88 34.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.873 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.77 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.1 pp -130.76 135.66 59.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.227 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.608 HD11 HD21 ' A' ' 4' ' ' LEU . 89.4 mt -84.0 148.67 26.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.707 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.419 ' HG ' ' CD2' ' A' ' 56' ' ' PHE . 0.7 OUTLIER -103.45 -68.38 0.84 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.968 -179.89 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.65 171.09 19.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.073 0.464 . . . . 0.0 111.303 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.688 HD13 ' N ' ' A' ' 82' ' ' GLY . 1.2 tm? -124.57 131.92 53.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.683 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.688 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -150.6 -161.91 10.27 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.712 -179.853 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -139.39 168.84 18.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.81 0.338 . . . . 0.0 110.824 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.414 ' HA ' HD11 ' A' ' 66' ' ' LEU . 2.3 t-160 -59.23 -27.78 66.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.12 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.4 m -89.99 -18.62 25.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.302 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -84.66 -67.62 0.78 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.789 0.328 . . . . 0.0 111.233 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.589 HD13 HD12 ' A' ' 66' ' ' LEU . 7.0 mp -52.52 -32.1 38.8 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.327 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.885 -179.999 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 mmt . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.747 0.308 . . . . 0.0 111.17 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.1 mp -75.15 138.21 41.86 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.051 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.36 163.06 3.24 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.651 179.676 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.781 HD13 ' HA ' ' A' ' 35' ' ' ARG . 1.3 tt -125.65 145.27 50.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.889 0.376 . . . . 0.0 110.985 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.462 ' HB2' HG22 ' A' ' 77' ' ' ILE . 5.5 t-20 -134.15 -176.64 4.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.988 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.7 mt -145.76 136.14 24.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.907 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -104.89 171.41 7.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.816 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.43 -34.07 72.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.937 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.9 m -66.04 -31.55 72.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.915 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.8 t80 -77.26 -32.75 55.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.915 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 87.8 mm-40 -69.94 -28.98 66.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.155 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.5 pttt -90.15 -53.26 4.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.241 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -53.61 -25.51 17.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.032 0.444 . . . . 0.0 111.133 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.895 ' O ' HD13 ' A' ' 18' ' ' LEU . 51.6 t80 -64.14 -71.21 0.18 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.724 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.411 ' HA ' ' HB2' ' A' ' 18' ' ' LEU . 1.0 OUTLIER -68.0 -26.21 65.79 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.427 179.121 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.3 ttmm -69.97 -31.02 68.52 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.675 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.475 ' O ' ' HB3' ' A' ' 22' ' ' PHE . 33.2 tp -90.28 -40.32 12.22 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 179.089 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.895 HD13 ' O ' ' A' ' 14' ' ' PHE . 4.7 mp -53.45 -36.27 61.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.01 179.759 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.528 ' C ' HD12 ' A' ' 19' ' ' LEU . 4.5 pp -90.08 -9.89 46.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.525 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -93.48 37.17 1.06 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.656 0.265 . . . . 0.0 111.204 -179.713 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.81 23.03 40.24 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.843 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.577 ' CZ ' HG13 ' A' ' 26' ' ' VAL . 34.7 t80 -116.77 112.11 20.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.838 0.352 . . . . 0.0 110.783 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.466 ' O ' HG12 ' A' ' 26' ' ' VAL . 3.7 t0 -57.52 146.46 29.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.083 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.654 ' HA ' HD23 ' A' ' 27' ' ' LEU . 20.3 p-10 -86.31 -11.31 52.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.18 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.9 t -78.62 -27.27 45.45 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.7 0.286 . . . . 0.0 110.998 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.577 HG13 ' CZ ' ' A' ' 22' ' ' PHE . 10.0 p -80.02 -27.43 12.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.326 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.654 HD23 ' HA ' ' A' ' 24' ' ' ASP . 1.5 pp -59.13 -38.57 79.97 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.107 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 15.8 t30 -59.23 -23.9 62.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.176 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -80.05 -45.32 18.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.145 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.779 ' CG2' HD13 ' A' ' 61' ' ' ILE . 12.4 p -77.69 -48.39 24.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.45 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.838 ' HA ' HD12 ' A' ' 34' ' ' LEU . 1.2 mp -57.05 -29.72 32.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.901 0.381 . . . . 0.0 110.43 179.584 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.807 HD23 ' N ' ' A' ' 33' ' ' THR . 0.2 OUTLIER -61.36 -65.85 0.63 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.273 179.382 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.807 ' N ' HD23 ' A' ' 32' ' ' LEU . 85.4 m -46.23 -24.26 0.44 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.937 -179.72 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.838 HD12 ' HA ' ' A' ' 31' ' ' ILE . 3.3 mt -89.29 -49.79 6.51 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.781 ' HA ' HD13 ' A' ' 4' ' ' LEU . 35.3 mtt180 -83.26 -16.82 44.85 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -178.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.535 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -94.38 18.88 10.36 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.624 0.249 . . . . 0.0 111.45 -179.619 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.434 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 1.3 ptpp? 45.49 48.37 10.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.33 179.921 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.595 ' HB3' HG23 ' A' ' 33' ' ' THR . 2.8 tp10 -90.63 136.97 27.41 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.783 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -68.07 137.08 39.83 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.453 2.102 . . . . 0.0 112.288 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.635 HD22 ' SG ' ' A' ' 59' ' ' CYS . 2.6 mt -96.15 148.33 22.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.911 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.37 164.07 21.19 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.92 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.41 -29.66 45.24 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.578 2.185 . . . . 0.0 112.252 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -19.67 65.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.101 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.424 ' CE2' ' HA ' ' A' ' 61' ' ' ILE . 4.8 m-85 -62.64 -17.87 61.22 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.234 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 73.8 mm-40 66.73 38.72 3.8 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.874 0.368 . . . . 0.0 110.881 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -76.75 122.11 24.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.893 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -168.0 -178.08 3.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.877 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.19 134.76 36.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.027 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.2 mt -70.11 -176.64 1.19 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.928 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.78 -178.32 3.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.967 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 65.81 -140.47 40.4 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.528 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.0 -7.65 54.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.532 0.206 . . . . 0.0 111.369 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 5.0 m95 -96.17 37.6 1.24 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.88 0.372 . . . . 0.0 110.832 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.503 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -69.88 -50.24 17.82 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.407 179.997 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 64.0 Cg_endo -74.58 51.62 2.67 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.175 1.916 . . . . 0.0 112.66 -179.811 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.655 ' HD1' HD13 ' A' ' 70' ' ' LEU . 63.8 m-85 -152.99 175.59 12.79 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.761 179.585 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.24 144.62 44.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.922 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.502 ' OE2' HD22 ' A' ' 87' ' ' LEU . 2.1 tt0 -113.26 171.63 7.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.749 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.635 ' SG ' HD22 ' A' ' 40' ' ' LEU . 8.2 t -168.34 110.75 0.57 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.925 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.593 ' CD2' HD22 ' A' ' 66' ' ' LEU . 10.8 m170 -84.9 83.62 7.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.94 179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.779 HD13 ' CG2' ' A' ' 30' ' ' VAL . 4.0 mp -53.63 -27.59 15.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.037 179.723 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.487 ' NZ ' HG22 ' A' ' 26' ' ' VAL . 0.0 OUTLIER -159.49 169.74 9.93 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.382 179.714 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.434 ' CD ' ' HB2' ' A' ' 62' ' ' LYS . 15.3 Cg_exo -68.77 5.52 1.31 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.705 2.27 . . . . 0.0 113.29 -179.467 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -138.9 24.69 2.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.56 0.219 . . . . 0.0 111.39 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.871 ' O ' HD23 ' A' ' 66' ' ' LEU . 42.0 t -155.35 145.68 12.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 121.036 0.446 . . . . 0.0 111.603 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.871 HD23 ' O ' ' A' ' 65' ' ' VAL . 15.7 mt -141.68 107.52 5.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.428 179.506 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.641 ' C ' HD13 ' A' ' 67' ' ' LEU . 2.5 tm? -99.84 134.05 43.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.933 0.397 . . . . 0.0 111.365 -179.608 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.524 ' H ' HD22 ' A' ' 67' ' ' LEU . 98.6 t -113.12 119.93 61.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.879 178.657 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.56 ' HB3' HD11 ' A' ' 67' ' ' LEU . 20.3 p90 -132.97 155.7 48.65 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.953 0.406 . . . . 0.0 111.323 -179.001 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.807 ' HB2' HD11 ' A' ' 77' ' ' ILE . 6.6 tp -109.54 171.09 7.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.852 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 20.2 t -122.93 104.98 15.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.262 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.0 164.41 24.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.776 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -41.94 -36.19 1.03 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.55 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -157.48 27.63 0.29 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.864 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -151.36 162.75 40.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.816 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.441 HD11 ' CD2' ' A' ' 69' ' ' TYR . 6.5 tp -114.03 147.6 38.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.583 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.807 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.2 pp -136.4 126.55 40.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.373 -179.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 78.5 mt -80.32 115.68 19.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.55 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.554 HD23 ' NH1' ' A' ' 80' ' ' ARG . 0.5 OUTLIER -72.5 -66.58 0.64 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.09 -179.82 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.599 ' O ' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -163.77 176.06 9.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.049 0.452 . . . . 0.0 111.331 179.802 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.767 HD11 HG13 ' A' ' 65' ' ' VAL . 1.4 tm? -131.86 117.44 18.51 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.714 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.483 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -120.71 -161.15 11.34 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.58 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.8 m -134.19 153.01 52.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.069 0.461 . . . . 0.0 110.912 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.848 ' HA ' HD11 ' A' ' 66' ' ' LEU . 0.6 OUTLIER -49.42 -28.48 5.23 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.344 -179.795 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 12.7 t -90.19 -20.67 22.77 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.239 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.5 -71.22 0.47 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.152 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.703 HD13 HD12 ' A' ' 66' ' ' LEU . 4.3 mp -49.93 -27.46 5.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.372 -179.661 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.215 -0.897 . . . . 0.0 110.916 179.982 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.948 0.404 . . . . 0.0 111.09 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 7.1 mt -86.89 167.74 14.05 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.008 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.85 146.94 40.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.874 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.405 HD21 HH21 ' A' ' 35' ' ' ARG . 0.6 OUTLIER -118.2 148.3 42.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.912 179.87 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.775 ' HB2' HG22 ' A' ' 77' ' ' ILE . 4.6 t30 -133.56 171.14 14.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.917 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.1 mt -137.97 104.13 5.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.9 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -78.41 165.94 23.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.816 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -60.39 -38.85 85.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.812 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.8 t -68.85 -31.45 70.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.924 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.474 ' CZ ' HD13 ' A' ' 78' ' ' LEU . 56.0 t80 -80.92 -37.34 29.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.936 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -57.22 -36.33 70.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.974 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.472 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 4.7 mtpm? -90.06 -17.87 26.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.14 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.452 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 3.9 m-20 -90.53 -17.26 27.34 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.276 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.568 ' O ' HD13 ' A' ' 18' ' ' LEU . 65.9 t80 -91.1 -68.43 0.79 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.425 -179.658 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.796 ' HA ' HD22 ' A' ' 18' ' ' LEU . 1.3 t0 -90.95 -40.9 11.43 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.472 ' HB3' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -70.36 -26.46 63.74 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.677 -0.409 . . . . 0.0 111.086 -179.117 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.452 ' HB2' ' HA ' ' A' ' 13' ' ' ASP . 20.5 tp -69.8 -33.32 72.2 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 179.012 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.796 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.1 OUTLIER -61.36 -30.77 70.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.802 179.904 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 21.6 mt -86.36 -32.8 20.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.066 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -60.89 -19.48 60.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.075 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 133.04 34.04 0.35 Allowed Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.574 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.482 ' HB3' ' HA ' ' A' ' 18' ' ' LEU . 12.1 t80 -113.2 146.51 39.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.737 0.303 . . . . 0.0 110.726 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.432 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 43.0 t0 -95.08 106.79 18.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.012 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -51.91 -24.99 7.13 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.317 -179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -50.68 -44.06 57.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.788 0.328 . . . . 0.0 111.158 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.6 t -77.28 -35.82 23.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.003 0.43 . . . . 0.0 111.059 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.662 HD11 HD13 ' A' ' 31' ' ' ILE . 3.9 tp -59.79 -40.31 87.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.641 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.439 ' O ' HD22 ' A' ' 32' ' ' LEU . 34.0 t30 -55.94 -42.45 76.19 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.053 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.53 ' C ' HD22 ' A' ' 32' ' ' LEU . 5.9 mm-40 -61.77 -16.62 51.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.4 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.479 ' CG1' HD13 ' A' ' 61' ' ' ILE . 60.8 t -90.33 -70.4 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.814 0.34 . . . . 0.0 111.807 -179.579 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.662 HD13 HD11 ' A' ' 27' ' ' LEU . 1.2 mp -50.66 -36.47 14.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.121 -0.49 . . . . 0.0 112.219 -178.898 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.721 HD23 ' N ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -67.24 -11.19 56.8 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 120.909 -0.316 . . . . 0.0 111.352 -179.869 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.721 ' N ' HD23 ' A' ' 32' ' ' LEU . 86.3 m -90.57 -35.84 14.8 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.925 0.393 . . . . 0.0 111.048 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.432 ' CD2' HD21 ' A' ' 40' ' ' LEU . 8.7 mt -90.06 -65.04 1.05 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.912 -179.137 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.442 ' HD2' HG23 ' A' ' 31' ' ' ILE . 12.2 mtt180 -49.54 -21.99 1.13 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.106 -179.129 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.544 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -90.49 21.25 4.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.638 0.256 . . . . 0.0 111.526 -179.882 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.438 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 0.2 OUTLIER 46.1 61.66 2.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.007 0.432 . . . . 0.0 111.513 -179.935 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -119.58 144.07 36.07 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.746 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.0 141.56 40.46 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.423 2.082 . . . . 0.0 112.379 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.716 HD22 ' CE2' ' A' ' 44' ' ' PHE . 54.0 mt -84.73 141.07 30.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.925 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.29 159.47 77.67 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.874 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -61.55 -27.03 81.38 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.603 2.202 . . . . 0.0 112.241 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -64.21 -26.54 68.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.971 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.716 ' CE2' HD22 ' A' ' 40' ' ' LEU . 3.1 m-30 -58.25 -53.53 57.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.76 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 60.91 83.53 0.14 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.959 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -92.53 105.35 17.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.878 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -130.69 -177.2 4.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.914 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -95.07 136.65 35.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.087 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.807 HD13 ' HB3' ' A' ' 53' ' ' TRP . 1.5 mp -70.11 -168.38 0.21 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.84 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.3 mmtt -137.8 150.34 47.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.791 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 60.39 110.52 0.01 OUTLIER Glycine 0 CA--C 1.507 -0.413 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.655 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.7 tptm 70.15 -45.67 0.59 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.713 0.292 . . . . 0.0 110.953 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.807 ' HB3' HD13 ' A' ' 49' ' ' LEU . 90.9 m95 -98.95 33.25 2.4 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.964 0.412 . . . . 0.0 110.822 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.484 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 1.3 tttm -70.1 -49.41 18.6 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.673 -179.865 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.484 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 72.9 Cg_endo -77.31 5.85 4.79 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.419 2.079 . . . . 0.0 113.191 -179.481 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -110.06 173.36 6.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.824 0.345 . . . . 0.0 110.959 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.755 ' O ' HG13 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -129.04 144.53 51.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.956 -179.858 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.657 ' HG3' HG22 ' A' ' 68' ' ' VAL . 4.1 tt0 -106.45 179.36 4.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.888 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.6 t -170.96 120.99 0.54 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.834 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -99.2 78.66 2.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.976 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.538 HD11 ' HB3' ' A' ' 67' ' ' LEU . 2.9 mp -59.6 -29.14 41.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.113 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.475 ' HB2' HG23 ' A' ' 65' ' ' VAL . 14.1 mtpt -135.84 168.73 16.02 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.85 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.405 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 12.1 Cg_exo -70.03 -1.08 8.1 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.871 2.38 . . . . 0.0 112.931 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 -143.06 26.66 1.66 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.704 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.79 ' O ' HD23 ' A' ' 66' ' ' LEU . 42.8 t -137.26 150.93 26.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.107 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.868 HD12 HD12 ' A' ' 87' ' ' LEU . 1.1 mt -147.91 87.5 1.62 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.614 179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.74 HD12 ' N ' ' A' ' 68' ' ' VAL . 6.4 tp -82.94 134.31 35.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.115 -179.615 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.755 HG13 ' O ' ' A' ' 57' ' ' ARG . 38.8 t -113.38 140.29 34.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.665 179.69 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 52.1 p90 -155.49 162.86 40.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.111 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.69 ' HB2' HD11 ' A' ' 77' ' ' ILE . 2.2 tp -112.35 173.08 6.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.833 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -127.42 102.33 8.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.205 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.34 164.57 26.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.798 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -43.44 -43.91 5.54 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.58 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -145.12 26.39 1.34 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.994 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -150.46 167.36 27.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.798 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.1 tt -126.15 134.81 51.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.727 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.775 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.4 pp -125.73 132.53 70.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.446 -179.763 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.474 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 92.5 mt -77.8 139.28 39.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.605 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -94.0 -64.56 1.07 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.013 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.484 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.2 OUTLIER -168.75 171.47 8.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.988 0.423 . . . . 0.0 111.206 -179.949 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.508 ' C ' HD13 ' A' ' 81' ' ' LEU . 2.7 tm? -128.54 121.61 29.18 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.696 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.479 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -137.42 -165.97 10.59 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.642 -0.789 . . . . 0.0 112.575 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.4 m -152.43 -171.55 3.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.904 0.383 . . . . 0.0 110.822 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 -73.39 -28.45 62.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.044 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.47 -23.21 22.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.13 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -89.89 -68.75 0.76 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.984 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.868 HD12 HD12 ' A' ' 66' ' ' LEU . 72.8 mt -59.1 -42.84 91.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.94 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.226 -0.892 . . . . 0.0 110.911 -179.959 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 ptm . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.828 0.347 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 21.0 mt -130.72 179.61 5.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.961 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.86 150.98 26.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.866 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.5 tt -122.08 144.89 48.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.977 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.656 ' HB2' HG22 ' A' ' 77' ' ' ILE . 5.9 t30 -130.56 179.18 6.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.955 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -140.64 121.87 14.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.911 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -92.87 168.85 10.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.929 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -65.53 -41.17 93.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.836 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.72 -32.83 74.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.856 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.562 ' HE1' HD13 ' A' ' 67' ' ' LEU . 51.8 t80 -69.72 -30.87 68.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.873 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -63.88 -50.82 67.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.946 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.564 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 46.6 mttp -76.5 -14.16 60.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.993 0.425 . . . . 0.0 111.264 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.447 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 3.8 m-20 -90.42 -11.78 39.42 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.798 179.551 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.865 ' O ' HD13 ' A' ' 18' ' ' LEU . 37.1 t80 -90.77 -74.97 0.48 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.138 -179.687 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -90.39 -31.79 16.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.842 -179.189 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.564 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -77.03 -13.1 60.0 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.626 -0.429 . . . . 0.0 110.816 -179.948 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.474 HD12 ' HB3' ' A' ' 20' ' ' ASN . 27.2 tp -86.98 -30.99 20.84 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 178.8 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.865 HD13 ' O ' ' A' ' 14' ' ' PHE . 4.2 mp -45.57 -51.27 12.22 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.309 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.5 pp -72.42 -6.44 43.55 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.001 -179.305 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.474 ' HB3' HD12 ' A' ' 17' ' ' LEU . 18.7 t-20 -93.29 37.63 1.04 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.745 0.307 . . . . 0.0 111.051 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.73 23.11 70.6 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.24 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.685 ' CD1' HD12 ' A' ' 18' ' ' LEU . 51.7 t80 -109.78 124.78 51.88 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.833 0.349 . . . . 0.0 110.832 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.504 ' HB3' HG12 ' A' ' 26' ' ' VAL . 18.0 t0 -64.67 141.36 58.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.927 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.894 ' HA ' HD23 ' A' ' 27' ' ' LEU . 2.4 p30 -94.0 -20.62 19.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.352 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.6 m -76.64 -26.43 54.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.831 0.348 . . . . 0.0 111.286 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.504 HG12 ' HB3' ' A' ' 23' ' ' ASP . 13.7 p -78.76 -33.29 16.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.373 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.894 HD23 ' HA ' ' A' ' 24' ' ' ASP . 1.3 pp -62.04 -36.95 83.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.043 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.56 ' O ' HD22 ' A' ' 32' ' ' LEU . 43.2 t-20 -58.89 -24.81 62.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.046 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.407 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 9.8 mt-10 -75.62 -33.95 60.54 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.1 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.697 HG13 HD12 ' A' ' 31' ' ' ILE . 11.4 p -90.7 -34.52 6.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.557 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.697 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -70.56 -48.05 61.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.749 -179.339 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.747 HD23 ' N ' ' A' ' 33' ' ' THR . 0.5 OUTLIER -60.19 -16.08 29.98 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.523 0.194 . . . . 0.0 111.523 -179.395 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.747 ' N ' HD23 ' A' ' 32' ' ' LEU . 88.6 m -90.18 -26.63 20.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.659 0.266 . . . . 0.0 111.115 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.5 mt -87.32 -46.72 9.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.398 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 68.8 mtp180 -74.22 -5.49 42.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.794 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.497 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -97.97 25.29 6.14 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.757 0.313 . . . . 0.0 111.438 -179.661 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.471 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 53.6 pttt 46.53 29.96 1.01 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.24 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -90.25 130.55 41.56 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.791 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -75.89 148.94 32.56 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.442 2.095 . . . . 0.0 112.422 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.489 HD13 ' SG ' ' A' ' 59' ' ' CYS . 16.0 mt -90.59 142.24 27.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.888 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.429 ' HB2' ' CE1' ' A' ' 44' ' ' PHE . 1.6 m-20 -73.71 157.25 87.72 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.03 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.6 -9.76 26.47 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.604 2.203 . . . . 0.0 112.557 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -96.23 30.97 2.31 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.766 0.317 . . . . 0.0 110.94 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.439 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.3 m-30 -100.42 -11.17 20.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.305 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 65.95 44.92 2.6 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.851 0.358 . . . . 0.0 110.925 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.9 p-10 -89.15 76.93 7.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.888 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -119.82 176.79 5.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.915 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.91 136.25 38.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.064 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.561 ' H ' HD12 ' A' ' 49' ' ' LEU . 2.5 mp -78.13 -172.69 2.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.914 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.0 mmtm -130.41 171.39 13.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.95 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.19 -128.17 11.47 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.5 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.7 mmtp -69.98 -23.25 63.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.705 0.288 . . . . 0.0 110.978 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 18.9 m-90 -96.68 31.82 2.22 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.889 0.376 . . . . 0.0 110.998 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.446 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.2 OUTLIER -66.12 -51.45 45.3 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.064 179.905 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 98.7 Cg_endo -80.09 46.56 2.27 Favored 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.422 2.081 . . . . 0.0 112.487 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -154.96 179.11 9.44 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.918 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 -139.69 138.98 36.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.872 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.434 ' HG3' HG22 ' A' ' 68' ' ' VAL . 2.1 tt0 -98.44 176.77 5.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.489 ' SG ' HD13 ' A' ' 40' ' ' LEU . 12.0 t -170.72 102.64 0.24 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.881 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.637 ' CE1' HD22 ' A' ' 66' ' ' LEU . 0.2 OUTLIER -83.2 82.98 8.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.032 -179.995 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.589 HG21 HG23 ' A' ' 30' ' ' VAL . 2.7 mp -61.65 -35.12 65.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.077 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.417 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 7.6 mmmt -131.03 169.32 14.02 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.673 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.417 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 16.9 Cg_exo -66.83 -5.29 12.95 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.634 2.223 . . . . 0.0 112.79 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -142.92 27.48 1.63 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.829 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.909 ' O ' HD23 ' A' ' 66' ' ' LEU . 98.0 t -135.52 137.98 48.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.177 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.909 HD23 ' O ' ' A' ' 65' ' ' VAL . 9.0 mt -139.86 93.79 2.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.794 179.559 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.64 HD12 ' N ' ' A' ' 68' ' ' VAL . 2.6 tp -92.36 119.24 31.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.844 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.64 ' N ' HD12 ' A' ' 67' ' ' LEU . 50.3 t -93.74 136.05 26.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.021 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.428 ' CZ ' ' HB2' ' A' ' 59' ' ' CYS . 2.2 p90 -147.8 158.61 44.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.759 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.741 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.4 OUTLIER -104.28 144.35 31.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.866 -179.968 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.521 ' HA ' HD12 ' A' ' 76' ' ' LEU . 8.7 p -82.83 158.96 3.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.021 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.506 ' N ' HG22 ' A' ' 71' ' ' VAL . 0.0 OUTLIER -157.44 155.84 31.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.926 179.599 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.67 107.29 0.49 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.003 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 58.29 23.41 10.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.116 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -158.1 154.66 27.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.886 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.521 HD12 ' HA ' ' A' ' 71' ' ' VAL . 4.6 tp -133.89 140.24 46.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.723 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.741 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.0 pp -122.64 134.61 65.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.189 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 71.3 mt -74.19 151.94 39.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.912 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.735 HD12 HH11 ' A' ' 80' ' ' ARG . 0.2 OUTLIER -112.62 -68.62 0.92 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.884 179.976 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.735 HH11 HD12 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -158.62 168.81 25.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.078 179.999 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.659 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.3 tm? -118.63 133.95 55.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.733 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.659 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -150.3 -164.57 11.96 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.58 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.4 p -144.48 171.78 13.88 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.724 0.297 . . . . 0.0 110.832 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.579 ' HA ' HD11 ' A' ' 66' ' ' LEU . 2.5 t-80 -58.65 -28.33 65.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.016 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.2 t -86.38 -30.05 22.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.94 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.37 -74.93 0.31 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.906 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.745 HD12 ' HB2' ' A' ' 66' ' ' LEU . 34.7 mt -60.25 -34.61 73.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.854 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.85 179.982 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 mtp . . . . . 0 N--CA 1.488 1.435 0 CA-C-O 120.851 0.358 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.1 mt 60.35 -171.14 0.14 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.98 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.66 156.47 13.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.908 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.789 HD11 HD11 ' A' ' 78' ' ' LEU . 7.1 tt -124.68 151.37 45.03 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.977 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.662 ' HB2' HG22 ' A' ' 77' ' ' ILE . 1.4 t-20 -138.13 174.28 10.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.852 179.87 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.0 mt -127.67 142.58 51.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.871 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.5 mmpt? -112.93 164.55 13.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.907 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.3 pttt -54.71 -53.21 57.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.183 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.41 ' CB ' ' HB3' ' A' ' 80' ' ' ARG . 55.8 m -57.62 -37.68 73.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.121 -179.81 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.471 ' CZ ' HD13 ' A' ' 78' ' ' LEU . 36.0 t80 -62.45 -27.69 69.29 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.99 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -77.7 -38.47 47.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.092 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.412 ' O ' ' CB ' ' A' ' 16' ' ' LYS . 6.1 ptmt -89.96 -8.59 51.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.601 -179.778 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -90.44 -23.52 20.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.792 0.33 . . . . 0.0 111.116 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.591 ' HZ ' HD13 ' A' ' 27' ' ' LEU . 37.1 t80 -90.29 -68.86 0.76 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.439 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -49.96 -33.07 16.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.995 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.426 ' O ' ' ND2' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -79.45 -23.66 42.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.862 179.715 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.454 ' HG ' ' CG ' ' A' ' 22' ' ' PHE . 36.6 tp -86.46 -50.53 6.81 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.689 HD13 ' HD2' ' A' ' 22' ' ' PHE . 4.2 mm? -50.55 -36.08 32.77 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.1 179.749 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 27.0 mt -90.01 -7.75 53.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.798 -179.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.426 ' ND2' ' O ' ' A' ' 16' ' ' LYS . 3.1 m-20 -93.77 35.85 1.12 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.877 0.37 . . . . 0.0 111.149 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 80.11 22.85 62.42 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.684 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.689 ' HD2' HD13 ' A' ' 18' ' ' LEU . 71.7 t80 -98.72 107.96 20.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.783 0.325 . . . . 0.0 110.609 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.751 ' HB3' HG23 ' A' ' 26' ' ' VAL . 2.2 t0 -52.77 124.13 13.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.037 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.58 ' HA ' HD23 ' A' ' 27' ' ' LEU . 7.4 p-10 -62.43 -38.4 89.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.119 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.6 t -54.1 -24.59 18.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.245 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.751 HG23 ' HB3' ' A' ' 23' ' ' ASP . 34.5 t -79.61 -35.48 16.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.286 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.591 HD13 ' HZ ' ' A' ' 14' ' ' PHE . 1.0 OUTLIER -57.67 -35.99 71.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.954 -179.871 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.734 ' O ' HD22 ' A' ' 32' ' ' LEU . 6.1 t-20 -63.7 -15.86 59.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.36 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -90.1 -35.58 15.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.694 0.283 . . . . 0.0 111.328 -179.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.765 ' CG2' HD13 ' A' ' 61' ' ' ILE . 10.0 p -90.63 -36.05 7.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -179.325 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.643 ' CD1' HG13 ' A' ' 30' ' ' VAL . 1.6 mp -76.21 -42.07 37.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 111.642 0.238 . . . . 0.0 111.642 -179.163 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.761 HD23 ' N ' ' A' ' 33' ' ' THR . 0.4 OUTLIER -64.51 -14.37 56.97 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.447 -179.553 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.761 ' N ' HD23 ' A' ' 32' ' ' LEU . 99.9 m -90.36 -25.68 20.32 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 120.767 0.317 . . . . 0.0 110.904 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.8 mt -86.3 -36.78 19.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.555 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.6 mtp-105 -93.5 20.36 7.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.643 -179.522 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.54 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -126.85 18.71 7.24 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.598 0.222 . . . . 0.0 111.598 -179.793 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.458 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 12.4 pttm 45.72 30.01 0.76 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.907 0.384 . . . . 0.0 111.085 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.02 148.13 78.11 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.9 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -74.44 161.4 40.19 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.5 2.133 . . . . 0.0 112.463 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.2 mt -130.14 123.4 30.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.991 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.61 156.91 29.86 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.914 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -62.34 -24.17 75.63 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.543 2.162 . . . . 0.0 112.281 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -63.51 -23.7 67.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.037 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.423 ' O ' ' CD2' ' A' ' 60' ' ' HIS . 44.6 m-85 -69.34 -10.54 58.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.455 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 58.91 34.69 23.79 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.861 0.362 . . . . 0.0 111.066 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -66.4 78.11 0.1 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.837 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 73.1 m80 -138.95 177.62 7.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.019 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.31 137.02 44.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.09 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.537 HD13 ' HB3' ' A' ' 53' ' ' TRP . 0.4 OUTLIER -74.89 -171.09 1.22 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.819 179.906 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -144.1 149.78 37.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.929 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 65.98 109.17 0.01 OUTLIER Glycine 0 CA--C 1.506 -0.474 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.841 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.4 mptt 69.18 -45.95 0.56 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.528 0.204 . . . . 0.0 111.181 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.537 ' HB3' HD13 ' A' ' 49' ' ' LEU . 17.8 m95 -101.95 33.93 2.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.855 0.359 . . . . 0.0 111.073 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.464 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 22.9 tttm -64.15 -49.42 73.66 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.303 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.464 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 89.1 Cg_endo -79.76 46.89 2.35 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.362 2.041 . . . . 0.0 112.745 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.551 ' CE1' HD11 ' A' ' 79' ' ' LEU . 69.1 m-85 -153.02 -176.51 5.8 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.732 0.301 . . . . 0.0 110.962 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.407 ' NH1' ' HB2' ' A' ' 57' ' ' ARG . 18.5 ttm105 -137.33 141.99 41.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.153 -179.749 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -106.81 161.97 14.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.793 179.689 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 9.1 t -171.27 100.24 0.2 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.906 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.44 ' O ' ' CG ' ' A' ' 60' ' ' HIS . 26.8 p80 -86.58 108.56 18.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.067 0.461 . . . . 0.0 110.827 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.765 HD13 ' CG2' ' A' ' 30' ' ' VAL . 4.6 mp -77.53 -31.9 18.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.852 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.538 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 5.6 mmtp -128.05 161.5 55.61 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.293 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.538 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 29.0 Cg_endo -62.98 -6.02 8.73 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.307 2.005 . . . . 0.0 112.747 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -135.84 25.81 3.34 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.694 179.556 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.863 ' O ' HD23 ' A' ' 66' ' ' LEU . 54.8 t -137.33 146.76 27.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.137 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.863 HD23 ' O ' ' A' ' 65' ' ' VAL . 4.7 mt -144.25 102.94 3.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.731 179.6 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.649 ' C ' HD13 ' A' ' 67' ' ' LEU . 3.3 tm? -92.58 131.19 37.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.008 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.604 ' N ' HD13 ' A' ' 67' ' ' LEU . 87.5 t -109.84 115.59 50.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.828 178.78 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.485 ' HB3' HD11 ' A' ' 67' ' ' LEU . 27.2 p90 -128.19 149.96 50.22 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.268 -179.073 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.793 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.4 OUTLIER -113.73 155.23 25.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.857 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.578 ' H ' HD23 ' A' ' 70' ' ' LEU . 21.5 t -107.04 129.95 59.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.176 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.47 173.2 7.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.784 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -56.92 101.93 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.912 0.387 . . . . 0.0 110.981 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 54.85 23.48 4.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.149 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -150.68 133.91 16.2 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.938 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.464 HD12 ' HA ' ' A' ' 71' ' ' VAL . 6.6 tp -105.04 152.09 23.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.755 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.793 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.0 pp -138.29 142.89 34.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.429 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.789 HD11 HD11 ' A' ' 4' ' ' LEU . 58.1 mt -93.81 123.31 37.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.434 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.589 HD11 HD12 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -77.44 -60.37 2.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.078 -179.635 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.41 ' HB3' ' CB ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -173.87 167.05 4.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.081 0.467 . . . . 0.0 111.65 179.949 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.898 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.9 tm? -116.8 143.52 45.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.582 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.898 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -165.93 -165.63 23.59 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.841 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.0 p -138.84 -178.84 5.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.764 0.316 . . . . 0.0 110.795 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -62.89 -23.42 67.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.182 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.7 m -83.29 -30.19 27.76 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.163 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -86.03 -67.95 0.77 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.014 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.485 HD13 HD12 ' A' ' 66' ' ' LEU . 4.6 mp -56.15 -32.39 64.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.055 -179.762 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.941 -179.96 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.306 0 CA-C-O 120.784 0.326 . . . . 0.0 111.188 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 7.1 mt -98.24 153.51 18.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.835 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.61 145.95 50.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.824 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -113.59 151.43 31.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.945 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.829 ' HB2' HG22 ' A' ' 77' ' ' ILE . 2.7 t30 -137.13 -173.01 3.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.764 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.0 mp -144.73 136.84 26.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.976 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.55 172.7 6.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.938 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.2 mtmt -67.96 -46.16 72.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.949 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 35.3 m -59.69 -42.41 92.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.872 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.509 ' CE1' HD13 ' A' ' 67' ' ' LEU . 11.5 t80 -60.54 -36.85 79.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.746 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -63.53 -47.47 81.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.845 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.578 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 9.7 mttt -72.6 -23.47 60.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.102 0.477 . . . . 0.0 111.027 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.428 ' C ' ' HB2' ' A' ' 17' ' ' LEU . 82.7 m-20 -90.41 -10.28 44.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.057 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.559 ' O ' HD21 ' A' ' 18' ' ' LEU . 10.1 t80 -90.85 -68.4 0.79 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.904 179.757 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -91.38 -36.7 13.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.214 -179.489 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.578 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 2.1 ttmt -76.21 -16.58 59.8 Favored 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 120.89 -0.324 . . . . 0.0 111.689 -178.709 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.431 HD22 ' HB2' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -81.88 -35.31 29.4 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.137 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.821 HD13 ' CB ' ' A' ' 24' ' ' ASP . 1.4 mt -61.53 -35.76 78.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.952 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 pp -89.93 11.58 20.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.348 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -114.06 28.69 8.56 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.859 0.362 . . . . 0.0 110.945 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.04 25.03 32.84 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.647 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.441 ' CD2' ' N ' ' A' ' 23' ' ' ASP . 50.9 t80 -115.09 164.22 14.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.775 0.321 . . . . 0.0 110.872 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.633 ' HB3' HG23 ' A' ' 26' ' ' VAL . 11.9 t70 -98.65 114.99 27.69 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.965 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.821 ' CB ' HD13 ' A' ' 18' ' ' LEU . 6.8 p-10 -66.44 -31.16 71.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.893 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.1 t -56.7 -37.0 70.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.186 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.633 HG23 ' HB3' ' A' ' 23' ' ' ASP . 46.9 t -60.76 -35.71 66.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.204 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.442 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.6 OUTLIER -65.48 -33.76 76.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.791 -179.815 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.819 ' O ' HD22 ' A' ' 32' ' ' LEU . 8.1 t-20 -65.9 -14.38 61.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.4 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.445 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 3.1 mt-10 -90.14 -33.76 16.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.731 0.301 . . . . 0.0 111.113 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 1.13 HG23 HG21 ' A' ' 61' ' ' ILE . 8.0 p -90.82 -43.06 14.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.659 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.753 HD12 HG13 ' A' ' 30' ' ' VAL . 1.6 mp -62.26 -57.73 10.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.639 -179.248 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.819 HD22 ' O ' ' A' ' 28' ' ' ASN . 0.9 OUTLIER -49.55 -21.43 0.98 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -178.855 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.669 ' N ' HD23 ' A' ' 32' ' ' LEU . 89.1 m -90.08 -34.23 16.0 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.676 0.274 . . . . 0.0 111.24 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.85 HD21 HD21 ' A' ' 40' ' ' LEU . 83.0 mt -86.43 -30.84 21.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.668 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.491 ' HG3' HG23 ' A' ' 31' ' ' ILE . 2.2 mtt85 -92.38 20.18 6.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.745 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.591 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -113.74 -50.94 2.82 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.796 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.543 ' H ' ' HG3' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 153.93 -20.65 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 122.699 0.4 . . . . 0.0 111.008 179.752 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.458 ' OE1' HG23 ' A' ' 33' ' ' THR . 24.4 tt0 -64.08 111.44 5.44 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.173 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -78.82 131.48 10.19 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.508 2.139 . . . . 0.0 112.273 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.85 HD21 HD21 ' A' ' 34' ' ' LEU . 6.7 mt -59.57 166.95 2.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.926 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -108.73 163.28 17.33 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.09 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.94 -12.75 31.08 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.618 2.212 . . . . 0.0 112.545 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 -82.91 2.95 31.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.374 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -95.23 20.97 8.47 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.708 0.29 . . . . 0.0 111.185 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 61.18 46.72 7.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.897 0.379 . . . . 0.0 111.037 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.4 p-10 -89.52 96.61 10.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.937 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 21.6 p-80 -152.08 -178.07 6.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.931 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -87.02 128.48 35.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.13 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.599 ' H ' HD12 ' A' ' 49' ' ' LEU . 4.6 mp -65.62 -175.78 0.3 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.889 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.1 mtmt -117.34 161.19 19.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.898 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.95 -116.52 4.68 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.575 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.14 -14.75 21.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.601 0.239 . . . . 0.0 111.313 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 19.3 m95 -96.24 31.08 2.28 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.061 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.4 OUTLIER -75.53 -51.44 3.2 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.028 179.844 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 50.9 Cg_exo -54.01 -18.69 13.83 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.424 2.082 . . . . 0.0 112.437 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -98.89 175.07 6.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.854 0.359 . . . . 0.0 110.992 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.653 HH21 HG21 ' A' ' 71' ' ' VAL . 0.3 OUTLIER -128.61 132.54 48.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.877 179.888 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.447 ' HG3' HD21 ' A' ' 49' ' ' LEU . 2.4 tt0 -95.96 172.76 7.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.072 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 3.2 t -170.18 116.19 0.52 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.638 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.6 m170 -88.57 84.62 6.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.111 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 1.13 HG21 HG23 ' A' ' 30' ' ' VAL . 3.5 mp -59.05 -27.89 37.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.85 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.439 ' HB2' HG23 ' A' ' 65' ' ' VAL . 7.1 mttp -139.62 168.92 13.47 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.538 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.418 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 17.2 Cg_exo -66.92 -2.93 8.65 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.653 2.235 . . . . 0.0 112.884 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -145.42 29.56 1.15 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.914 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.88 ' O ' HD23 ' A' ' 66' ' ' LEU . 42.2 t -139.6 151.25 22.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.215 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.88 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.0 OUTLIER -157.09 104.09 2.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.595 179.812 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.509 HD13 ' CE1' ' A' ' 10' ' ' PHE . 1.1 tp -105.2 116.65 32.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.669 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.446 HG22 ' HG3' ' A' ' 58' ' ' GLU . 34.1 t -85.43 141.86 13.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.222 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.637 ' CD1' HD11 ' A' ' 76' ' ' LEU . 38.3 p90 -147.41 163.6 35.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.963 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.762 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.3 OUTLIER -112.82 157.14 21.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.867 179.98 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.663 ' H ' HD23 ' A' ' 70' ' ' LEU . 21.5 t -111.44 115.02 48.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.099 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.1 163.62 16.13 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.857 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -42.75 -35.61 1.2 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.55 -179.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -156.62 26.53 0.34 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.084 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -149.37 155.88 41.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.768 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.637 HD11 ' CD1' ' A' ' 69' ' ' TYR . 9.8 tp -113.73 132.16 55.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.723 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.829 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.2 pp -126.3 130.39 71.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.367 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 72.7 mt -74.13 142.18 45.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.637 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.82 -75.55 0.56 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.169 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.5 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -146.95 179.6 7.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.84 0.352 . . . . 0.0 111.287 -179.724 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.597 ' C ' HD13 ' A' ' 81' ' ' LEU . 2.9 tm? -139.6 134.9 32.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.765 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.516 ' H ' HD22 ' A' ' 81' ' ' LEU . . . -179.73 176.53 47.62 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.586 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.435 ' C ' HD11 ' A' ' 66' ' ' LEU . 14.6 m -112.42 175.32 5.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.829 0.347 . . . . 0.0 110.827 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.57 ' N ' HD11 ' A' ' 66' ' ' LEU . 46.7 t-80 -59.79 -32.04 70.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.852 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -78.77 -21.32 48.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.045 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.15 -49.69 6.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.833 0.349 . . . . 0.0 110.845 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.6 HD12 HD12 ' A' ' 66' ' ' LEU . 12.4 mt -82.4 -40.94 20.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.977 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.935 -179.964 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.9 ttp . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 120.77 0.319 . . . . 0.0 111.535 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.93 HD12 ' HB2' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -129.92 158.34 39.78 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.895 179.981 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.45 152.53 21.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.029 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 7.7 tt -128.54 138.43 52.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.744 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.688 ' HB2' HG22 ' A' ' 77' ' ' ILE . 4.9 t30 -119.59 179.06 4.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.987 -179.894 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.454 HD11 ' NH2' ' A' ' 35' ' ' ARG . 0.6 OUTLIER -147.08 122.74 10.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.818 179.974 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.528 ' NZ ' HD13 ' A' ' 77' ' ' ILE . 8.4 mttp -103.17 169.3 8.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.871 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 7.0 tttt -65.83 -43.58 88.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.855 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.5 m -58.76 -29.88 67.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.974 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.551 ' HE1' HD13 ' A' ' 67' ' ' LEU . 38.7 t80 -77.14 -41.56 41.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.949 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -58.82 -45.13 90.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.866 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.476 ' O ' ' N ' ' A' ' 16' ' ' LYS . 2.7 mmmt -73.51 -45.06 56.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.026 0.441 . . . . 0.0 110.717 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.58 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -49.3 -25.76 2.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.982 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.617 ' CE1' HD22 ' A' ' 27' ' ' LEU . 75.9 t80 -91.49 -72.47 0.58 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.033 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.553 ' HA ' HD12 ' A' ' 18' ' ' LEU . 9.1 t70 -51.01 -45.3 61.16 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.357 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.476 ' N ' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -72.94 -13.5 61.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.36 -179.853 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.58 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 5.6 mt -90.34 -53.49 4.43 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 121.025 0.44 . . . . 0.0 110.356 179.474 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.553 HD12 ' HA ' ' A' ' 15' ' ' ASP . 0.5 OUTLIER -52.32 -33.87 44.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.219 -179.855 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.654 ' O ' HD12 ' A' ' 19' ' ' LEU . 4.3 pp -90.06 13.94 13.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.237 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -123.79 13.29 9.24 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.556 0.217 . . . . 0.0 111.406 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.41 29.16 5.77 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.787 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -110.73 118.13 35.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.888 0.375 . . . . 0.0 110.779 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.717 ' HB3' HG23 ' A' ' 26' ' ' VAL . 1.2 t70 -58.51 119.89 7.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.871 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.597 ' HA ' HD23 ' A' ' 27' ' ' LEU . 3.5 p-10 -66.17 -30.3 70.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.952 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 94.1 p -57.23 -27.51 62.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.153 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.717 HG23 ' HB3' ' A' ' 23' ' ' ASP . 31.4 t -71.96 -37.83 62.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.336 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.617 HD22 ' CE1' ' A' ' 14' ' ' PHE . 1.0 OUTLIER -59.76 -34.94 73.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.02 -179.819 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.533 ' O ' HD22 ' A' ' 32' ' ' LEU . 6.0 t-20 -61.25 -18.15 56.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.283 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.413 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 51.1 mt-10 -88.98 -35.76 16.22 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.78 0.324 . . . . 0.0 111.331 -179.759 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.916 HG13 HD12 ' A' ' 31' ' ' ILE . 15.0 p -90.69 -31.13 5.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.932 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.916 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -75.35 -47.98 32.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.658 -179.364 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.623 HD23 ' N ' ' A' ' 33' ' ' THR . 0.6 OUTLIER -56.34 -22.69 32.48 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.134 -179.539 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.623 ' N ' HD23 ' A' ' 32' ' ' LEU . 94.4 m -85.39 -27.39 25.84 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.673 0.273 . . . . 0.0 111.208 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.2 mt -84.64 -33.72 23.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.312 -179.471 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.454 ' NH2' HD11 ' A' ' 6' ' ' LEU . 1.0 OUTLIER -96.68 20.35 10.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.303 -179.89 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.542 ' O ' ' HG3' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -119.29 27.08 9.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.409 -179.768 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.542 ' HG3' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 35.6 36.14 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.67 -179.906 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -102.79 132.71 20.96 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.667 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -74.66 138.31 23.75 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.407 2.071 . . . . 0.0 112.524 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 6.0 mt -88.22 134.49 33.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.702 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -61.79 152.94 74.19 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.007 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.64 -8.25 23.18 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.532 2.155 . . . . 0.0 112.682 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.14 6.76 27.76 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.344 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -90.02 9.12 29.21 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.583 0.23 . . . . 0.0 111.316 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 36.2 mm-40 57.77 41.01 25.73 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.939 0.399 . . . . 0.0 111.057 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -87.54 86.56 7.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.984 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -139.84 -172.0 3.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.952 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.58 148.77 44.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.199 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.46 HD13 ' HB2' ' A' ' 56' ' ' PHE . 1.7 mp -84.74 177.68 7.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.875 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.18 156.76 22.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.89 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.95 -131.46 10.75 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.609 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.42 -13.92 50.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.56 0.219 . . . . 0.0 111.276 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 8.9 m95 -95.49 23.83 5.68 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.661 0.267 . . . . 0.0 111.291 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.463 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.4 OUTLIER -60.67 -49.16 90.95 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.047 179.988 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.463 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 36.9 Cg_exo -57.42 -16.85 24.73 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.449 2.099 . . . . 0.0 112.43 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.46 ' HB2' HD13 ' A' ' 49' ' ' LEU . 96.7 m-85 -93.3 176.31 6.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.867 0.365 . . . . 0.0 111.02 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.527 ' O ' HG13 ' A' ' 68' ' ' VAL . 22.2 ttm180 -132.29 137.88 47.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.899 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.406 ' HG3' HG22 ' A' ' 68' ' ' VAL . 3.8 tt0 -95.91 176.19 6.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.046 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 3.0 t -169.06 107.01 0.43 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.888 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -92.08 77.4 5.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.847 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.525 ' H ' HD12 ' A' ' 61' ' ' ILE . 4.3 mp -58.28 -28.97 36.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.061 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.402 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 1.3 mtpm? -139.06 169.47 12.38 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.875 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.402 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 11.3 Cg_exo -70.7 -2.47 10.9 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.77 2.313 . . . . 0.0 112.838 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -139.55 27.1 2.29 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.836 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.798 ' O ' HD23 ' A' ' 66' ' ' LEU . 46.2 t -140.13 149.97 21.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.016 0.436 . . . . 0.0 111.1 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.798 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.8 OUTLIER -148.6 91.46 1.89 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.608 179.87 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.739 HD12 ' N ' ' A' ' 68' ' ' VAL . 2.4 tp -91.42 122.76 34.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.962 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.739 ' N ' HD12 ' A' ' 67' ' ' LEU . 56.0 t -99.15 133.46 41.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.912 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.775 ' CD1' HD11 ' A' ' 76' ' ' LEU . 23.7 p90 -140.95 172.49 12.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.92 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.639 ' HB2' HD11 ' A' ' 77' ' ' ILE . 5.7 tp -118.5 136.12 54.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.872 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.515 HG22 ' N ' ' A' ' 72' ' ' LYS . 8.7 p -80.67 159.29 4.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.172 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.515 ' N ' HG22 ' A' ' 71' ' ' VAL . 0.0 OUTLIER -143.75 156.54 44.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.895 179.381 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -40.9 -32.3 0.22 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.837 -179.6 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -165.6 33.57 0.05 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.759 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -156.67 163.5 39.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.949 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.93 ' HB2' HD12 ' A' ' 2' ' ' LEU . 11.8 tp -125.9 139.62 53.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.712 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.688 HG22 ' HB2' ' A' ' 5' ' ' ASN . 1.8 pp -129.46 129.8 67.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.171 -179.853 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.542 HD13 ' CE2' ' A' ' 10' ' ' PHE . 66.8 mt -73.29 146.22 45.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.882 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.425 ' HG ' ' CD2' ' A' ' 56' ' ' PHE . 0.1 OUTLIER -112.98 -70.75 0.79 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.009 -179.891 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.87 157.48 37.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.041 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.581 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.4 tm? -111.49 133.7 53.59 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.032 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.581 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -136.99 -167.91 11.24 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.371 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.6 m -151.13 162.23 41.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.844 0.354 . . . . 0.0 110.795 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -55.75 -28.0 53.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.752 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 64.8 m -89.93 -27.43 19.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.826 179.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.06 -70.91 0.47 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.987 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.584 HD12 ' HB2' ' A' ' 66' ' ' LEU . 17.9 mt -68.81 -37.07 78.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.967 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.884 179.968 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 mtp . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.846 0.355 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.465 HD12 ' CB ' ' A' ' 76' ' ' LEU . 0.1 OUTLIER -151.23 162.7 40.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.845 179.968 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.63 150.51 32.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.973 -179.958 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.646 HD11 HD11 ' A' ' 78' ' ' LEU . 9.0 tt -119.33 148.08 43.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.833 179.945 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.743 ' HB2' HG22 ' A' ' 77' ' ' ILE . 4.9 t30 -135.14 -177.58 4.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.9 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.512 HD11 ' NH2' ' A' ' 35' ' ' ARG . 17.2 mt -146.73 133.6 20.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.975 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.4 mmmt -104.34 174.76 5.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.969 179.94 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.7 tttm -64.98 -33.11 75.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.951 -179.975 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 m -69.52 -46.62 66.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.972 179.96 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.612 ' CE1' HD13 ' A' ' 67' ' ' LEU . 23.5 t80 -59.74 -30.08 68.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.98 -179.994 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -60.42 -46.12 91.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.0 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.499 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 0.7 OUTLIER -73.85 -19.85 60.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.047 0.451 . . . . 0.0 111.174 -179.993 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.426 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 74.2 m-20 -90.46 -16.96 27.99 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.984 179.708 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.589 ' O ' HD13 ' A' ' 18' ' ' LEU . 20.4 t80 -90.99 -68.54 0.78 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.434 -179.506 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.801 ' HA ' HD22 ' A' ' 18' ' ' LEU . 38.8 t70 -91.01 -40.51 11.61 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -178.903 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.499 ' HB3' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -70.89 -24.8 62.55 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.35 -178.979 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.426 ' HB2' ' HA ' ' A' ' 13' ' ' ASP . 27.4 tp -72.54 -34.47 67.56 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 179.151 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.801 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.1 OUTLIER -57.63 -31.11 65.92 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.733 179.859 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 14.4 mt -89.97 -6.56 55.53 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.442 -179.984 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.68 28.3 3.48 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.732 0.301 . . . . 0.0 111.105 -179.861 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 92.89 23.05 26.43 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.814 179.804 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.502 ' CD1' HD12 ' A' ' 18' ' ' LEU . 11.1 t80 -113.79 135.44 53.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.857 0.361 . . . . 0.0 110.768 179.81 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.414 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 18.6 t0 -93.39 122.1 35.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.923 -179.98 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -58.3 -20.57 43.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.429 179.959 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 t -50.57 -55.42 16.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.732 0.301 . . . . 0.0 111.195 -179.88 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 37.9 t -67.2 -34.87 72.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.079 -179.952 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.839 ' CD1' HD13 ' A' ' 31' ' ' ILE . 5.4 tp -62.99 -29.93 71.2 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.715 179.949 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.581 ' O ' HD22 ' A' ' 32' ' ' LEU . 47.3 t30 -63.5 -22.88 67.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.212 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.481 ' HA ' HD22 ' A' ' 32' ' ' LEU . 3.6 mt-10 -87.07 -18.16 31.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.351 -179.896 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.708 HG13 HG21 ' A' ' 61' ' ' ILE . 66.3 t -90.26 -69.53 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.003 0.43 . . . . 0.0 111.613 -179.705 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.839 HD13 ' CD1' ' A' ' 27' ' ' LEU . 1.2 mp -48.42 -44.01 13.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.231 -178.975 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.583 HD23 ' N ' ' A' ' 33' ' ' THR . 0.4 OUTLIER -60.8 -15.94 35.4 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 121.079 -0.248 . . . . 0.0 111.568 -179.418 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.583 ' N ' HD23 ' A' ' 32' ' ' LEU . 85.7 m -90.08 -36.27 14.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.759 0.314 . . . . 0.0 111.025 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.9 mt -82.34 -29.61 30.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.331 -179.586 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.512 ' NH2' HD11 ' A' ' 6' ' ' LEU . 22.0 mtt180 -94.62 20.31 8.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.398 -179.76 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.474 ' O ' ' CG ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -126.68 26.76 6.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.068 -179.822 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.474 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 0.6 OUTLIER 47.33 53.67 10.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.178 -179.82 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -128.45 102.78 20.31 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.703 179.944 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -68.09 136.67 38.53 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.396 2.064 . . . . 0.0 112.341 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.625 HD13 ' SG ' ' A' ' 59' ' ' CYS . 1.2 mp -74.1 158.21 34.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.993 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.19 164.28 53.15 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.005 -179.909 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.53 -13.34 38.72 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.61 2.207 . . . . 0.0 112.487 179.941 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -86.89 7.49 27.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.421 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -93.53 14.17 19.61 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.109 179.941 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 58.76 38.69 24.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.91 0.386 . . . . 0.0 111.057 179.979 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.9 p-10 -83.62 79.74 9.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.892 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -137.43 176.11 9.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.94 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.69 152.45 37.51 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.143 -179.905 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.467 HD11 ' HG3' ' A' ' 58' ' ' GLU . 8.1 mt -97.15 -176.67 3.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.785 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -135.24 155.68 50.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.995 0.426 . . . . 0.0 110.899 -179.979 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 60.4 106.35 0.01 OUTLIER Glycine 0 CA--C 1.508 -0.387 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.704 179.951 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.53 -46.77 0.59 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.63 0.252 . . . . 0.0 111.074 179.939 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 62.3 m95 -99.63 33.33 2.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.823 0.344 . . . . 0.0 111.018 -179.881 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.44 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -71.63 -50.83 9.88 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.899 -179.948 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.44 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 14.1 Cg_exo -68.74 -7.08 19.55 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.639 2.226 . . . . 0.0 112.43 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.464 ' CD2' HD13 ' A' ' 70' ' ' LEU . 69.5 m-85 -102.2 178.3 4.64 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.949 0.404 . . . . 0.0 111.071 -179.785 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.627 ' O ' HG13 ' A' ' 68' ' ' VAL . 0.1 OUTLIER -137.47 144.64 42.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.726 -179.984 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.545 ' HG3' HG22 ' A' ' 68' ' ' VAL . 1.5 tt0 -107.18 168.57 9.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.998 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.625 ' SG ' HD13 ' A' ' 40' ' ' LEU . 15.0 t -168.33 123.8 0.98 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.896 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 9.1 m170 -93.28 93.17 8.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.97 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.708 HG21 HG13 ' A' ' 30' ' ' VAL . 4.4 mp -60.1 -31.56 48.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.861 179.895 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.442 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 6.1 mtpp -145.89 172.5 5.21 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.622 -179.932 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.442 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 17.4 Cg_exo -66.38 -4.29 10.39 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.672 2.248 . . . . 0.0 112.856 -179.888 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -142.02 29.07 1.68 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.861 179.792 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.518 ' C ' HD23 ' A' ' 66' ' ' LEU . 61.2 t -149.39 143.29 18.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.257 -180.0 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.789 HD12 HD13 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -159.13 118.71 3.03 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.683 179.961 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.612 HD13 ' CE1' ' A' ' 10' ' ' PHE . 0.2 OUTLIER -120.48 136.69 54.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.85 0.357 . . . . 0.0 110.968 -179.934 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.627 HG13 ' O ' ' A' ' 57' ' ' ARG . 57.1 t -91.53 137.13 22.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.894 -179.958 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -135.49 172.95 12.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.858 179.934 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.78 ' HB2' HD11 ' A' ' 77' ' ' ILE . 5.0 tp -117.23 162.23 18.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.905 -179.971 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.6 t -106.03 113.38 42.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.12 179.967 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -109.28 159.82 16.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.89 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -58.6 106.44 0.4 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.9 179.969 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.5 t70 57.4 26.59 12.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.101 -179.809 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -157.78 148.7 21.13 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.855 -179.988 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.465 ' CB ' HD12 ' A' ' 2' ' ' LEU . 7.6 tp -120.72 138.12 54.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.834 179.974 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.78 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.2 pp -124.84 135.61 63.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.198 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.646 HD11 HD11 ' A' ' 4' ' ' LEU . 58.4 mt -80.04 142.78 34.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.735 179.789 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.415 ' HG ' ' CD2' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -103.89 -71.69 0.72 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.06 -179.789 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.91 161.07 40.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.882 0.373 . . . . 0.0 111.349 -179.841 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.705 HD22 ' N ' ' A' ' 82' ' ' GLY . 1.7 tm? -123.73 133.44 53.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.635 179.911 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.705 ' N ' HD22 ' A' ' 81' ' ' LEU . . . -155.03 -176.95 27.82 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.572 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.7 t -121.5 172.31 8.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.803 0.335 . . . . 0.0 110.936 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -60.06 -28.41 67.77 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.873 179.988 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 49.3 p -82.86 -21.62 34.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.157 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.68 -66.81 0.86 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.809 0.338 . . . . 0.0 111.015 -179.827 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.789 HD13 HD12 ' A' ' 66' ' ' LEU . 6.7 mp -57.69 -37.15 72.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.084 -179.818 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.86 -179.934 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.2 mmm . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.849 0.357 . . . . 0.0 111.171 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 6.6 mt 59.95 167.71 0.07 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.964 179.981 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.89 150.54 45.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.863 179.875 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.741 HD11 HD11 ' A' ' 78' ' ' LEU . 7.6 tt -119.51 150.16 40.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.971 179.957 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.768 ' HB2' HG22 ' A' ' 77' ' ' ILE . 2.9 t30 -136.47 170.38 16.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.918 179.989 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 39.4 mt -131.18 117.76 19.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.798 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -87.61 165.68 15.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.947 179.911 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.0 mttt -66.89 -40.12 87.67 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.83 -179.973 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.9 t -58.96 -35.77 73.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.965 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 39.7 t80 -61.42 -30.16 70.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.008 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -75.95 -33.98 59.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.92 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.434 ' O ' ' CB ' ' A' ' 16' ' ' LYS . 60.6 mttt -89.98 -14.16 34.6 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.199 179.853 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.456 ' O ' ' CB ' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -90.31 -21.18 22.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.971 0.415 . . . . 0.0 110.434 179.394 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.506 ' O ' HD12 ' A' ' 18' ' ' LEU . 40.8 t80 -91.4 -74.65 0.5 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.951 179.461 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.552 ' HA ' HD12 ' A' ' 18' ' ' LEU . 0.2 OUTLIER -51.07 -47.99 61.69 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.781 -179.967 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.442 ' HA ' HD21 ' A' ' 19' ' ' LEU . 1.6 tppt? -71.87 -13.3 61.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.69 -179.455 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.463 ' HG ' ' CB ' ' A' ' 22' ' ' PHE . 28.3 tp -90.64 -51.31 5.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.933 0.397 . . . . 0.0 110.348 179.837 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.552 HD12 ' HA ' ' A' ' 15' ' ' ASP . 0.4 OUTLIER -55.76 -34.63 65.38 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.344 -179.904 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.575 ' C ' HD12 ' A' ' 19' ' ' LEU . 4.0 pp -80.81 -10.7 59.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.224 179.874 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.12 23.14 6.79 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.732 0.301 . . . . 0.0 111.203 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.73 42.36 7.78 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.725 179.806 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.467 ' HB3' ' HA ' ' A' ' 18' ' ' LEU . 89.2 t80 -114.5 122.49 46.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.823 0.344 . . . . 0.0 110.879 179.814 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.475 ' HB3' HG23 ' A' ' 26' ' ' VAL . 1.1 t70 -61.32 103.39 0.3 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.838 -179.979 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.868 ' HA ' HD23 ' A' ' 27' ' ' LEU . 3.1 p30 -64.01 -24.42 67.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.128 -179.914 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.2 m -61.68 -47.52 84.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.236 -179.77 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.475 HG23 ' HB3' ' A' ' 23' ' ' ASP . 39.9 t -56.03 -43.89 76.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.313 -179.682 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.868 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.4 OUTLIER -59.83 -30.4 68.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.825 -179.963 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.679 ' O ' HD22 ' A' ' 32' ' ' LEU . 5.2 t-20 -53.45 -32.01 48.05 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.677 179.835 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.456 ' C ' HD22 ' A' ' 32' ' ' LEU . 1.7 mm-40 -75.71 -20.24 58.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.865 179.677 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.828 HG21 HG11 ' A' ' 65' ' ' VAL . 87.0 t -90.52 -74.0 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.761 -179.695 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.6 mp -44.11 -45.53 2.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.452 -178.985 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.821 HD23 ' N ' ' A' ' 33' ' ' THR . 0.4 OUTLIER -58.92 -16.69 18.91 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.864 -0.334 . . . . 0.0 111.531 -179.453 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.821 ' N ' HD23 ' A' ' 32' ' ' LEU . 65.2 m -90.0 -27.63 19.63 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 120.79 0.328 . . . . 0.0 110.785 179.689 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 30.1 mt -85.92 -33.42 21.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.241 -179.728 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.0 mtm180 -94.69 20.28 8.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.4 -179.74 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.442 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.1 OUTLIER -122.72 22.3 9.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.374 -179.867 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.434 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 0.6 OUTLIER 45.38 45.83 10.22 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.293 -179.946 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -117.46 127.97 26.32 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.798 -179.992 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.51 154.58 55.31 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.436 2.09 . . . . 0.0 112.257 -179.983 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.535 HD22 ' SG ' ' A' ' 59' ' ' CYS . 3.5 mp -102.46 146.32 28.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.92 179.972 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -66.79 158.58 79.48 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.922 179.918 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.51 -29.05 53.26 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.51 2.14 . . . . 0.0 112.18 179.949 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.36 -20.42 62.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.062 179.966 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.498 ' CE2' HD23 ' A' ' 40' ' ' LEU . 4.0 m-85 -61.3 -23.52 65.76 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.035 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 62.05 42.19 10.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.955 -179.991 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -75.54 84.08 2.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.845 179.932 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -134.02 -168.67 2.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.87 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -84.33 138.29 32.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.251 179.931 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.448 HD11 ' HB2' ' A' ' 58' ' ' GLU . 3.0 mp -76.75 -174.15 2.91 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.837 179.966 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.4 mttm -125.23 153.71 42.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.879 179.962 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 96.32 -113.71 4.74 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.644 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.1 -19.56 20.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.602 0.239 . . . . 0.0 111.15 -179.871 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.412 ' HB2' ' HB2' ' A' ' 49' ' ' LEU . 36.3 m95 -96.37 30.64 2.46 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.87 0.367 . . . . 0.0 110.945 -179.963 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.535 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 2.6 mtpt -69.48 -54.77 10.49 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.536 -179.874 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 21.7 Cg_endo -61.37 -10.42 15.89 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.293 1.995 . . . . 0.0 112.788 -179.799 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.611 ' CE1' HD21 ' A' ' 79' ' ' LEU . 47.4 m-85 -104.75 172.31 6.86 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.874 0.368 . . . . 0.0 110.918 179.818 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.419 ' O ' HG13 ' A' ' 68' ' ' VAL . 1.3 ttm180 -120.31 158.29 27.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.783 -179.813 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.448 ' HB2' HD11 ' A' ' 49' ' ' LEU . 6.8 tp10 -123.95 162.96 22.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.036 -179.92 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.535 ' SG ' HD22 ' A' ' 40' ' ' LEU . 1.1 t -154.97 112.24 3.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.754 179.933 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -86.02 71.16 10.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 -179.88 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.75 HD11 ' HB3' ' A' ' 67' ' ' LEU . 3.8 mp -59.08 -27.14 35.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.07 179.818 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.415 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 3.3 mttp -148.73 164.77 20.02 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.637 -179.804 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.415 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 42.0 Cg_endo -67.4 -3.22 9.65 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.447 2.098 . . . . 0.0 112.848 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -139.19 26.71 2.39 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.675 179.708 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.828 HG11 HG21 ' A' ' 30' ' ' VAL . 52.1 t -143.42 146.16 21.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.264 -179.909 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.807 HD23 ' O ' ' A' ' 65' ' ' VAL . 1.7 mt -147.95 96.58 2.67 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.718 179.855 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.765 HD22 ' N ' ' A' ' 68' ' ' VAL . 1.4 tm? -84.51 134.87 34.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.01 -179.986 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.765 ' N ' HD22 ' A' ' 67' ' ' LEU . 94.7 t -106.83 119.83 57.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.399 179.261 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.735 ' CD2' HD11 ' A' ' 76' ' ' LEU . 13.6 p90 -136.13 178.32 7.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.062 -179.498 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.763 ' HB2' HD11 ' A' ' 77' ' ' ILE . 5.2 tp -130.29 168.5 16.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.914 179.977 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -120.47 110.01 27.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.117 -179.981 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.87 176.48 5.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.778 179.986 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -59.78 103.16 0.19 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.905 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 55.89 24.52 7.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.119 -179.855 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -149.61 153.56 37.26 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.91 -179.957 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.735 HD11 ' CD2' ' A' ' 69' ' ' TYR . 8.0 tt -123.88 144.14 49.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.684 179.853 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.768 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.5 pp -129.33 138.05 55.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.315 -179.788 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.741 HD11 HD11 ' A' ' 4' ' ' LEU . 89.6 mt -86.58 131.46 34.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.553 179.625 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.611 HD21 ' CE1' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -91.78 -74.17 0.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.104 -179.607 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.619 ' NH1' HD21 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -155.75 177.68 11.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.874 0.369 . . . . 0.0 111.345 -179.845 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.766 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.5 tm? -119.2 134.76 55.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.93 -179.885 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.766 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -140.61 -173.18 13.3 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.538 179.961 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.9 m -144.58 171.07 14.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.867 0.365 . . . . 0.0 110.99 -179.968 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -59.68 -28.45 67.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.95 179.91 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.2 m -87.83 -26.31 22.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.087 -179.985 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -80.67 -70.21 0.54 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.912 -179.932 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.807 HD12 HD12 ' A' ' 66' ' ' LEU . 1.0 OUTLIER -70.25 -38.29 75.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.01 -179.908 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.919 179.984 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.813 0.34 . . . . 0.0 111.217 . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.5 mt 60.8 160.86 0.05 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.015 179.832 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.12 150.72 28.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.851 179.927 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.547 HD11 HD11 ' A' ' 78' ' ' LEU . 1.7 tt -116.06 147.5 41.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.916 179.996 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.819 ' HB2' HG22 ' A' ' 77' ' ' ILE . 2.3 t30 -133.9 -178.39 5.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.943 179.945 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.3 mt -142.82 112.14 6.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.874 -179.93 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.2 mmtp -85.61 161.63 19.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.88 -179.997 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 17.4 mmtm -62.06 -30.85 71.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.951 179.969 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.0 t -72.15 -33.27 67.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.98 179.929 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.739 ' HE1' HD13 ' A' ' 67' ' ' LEU . 43.6 t80 -73.97 -31.1 62.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.904 -179.936 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -65.39 -40.72 93.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.929 179.977 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 17.5 mttt -88.63 -11.17 46.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.317 179.962 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.407 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 1.2 m-20 -90.44 -26.21 19.96 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.828 0.347 . . . . 0.0 110.415 179.516 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.791 ' O ' HD13 ' A' ' 18' ' ' LEU . 66.4 t80 -91.09 -70.71 0.67 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.177 179.866 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.702 ' HA ' HD22 ' A' ' 18' ' ' LEU . 4.2 t0 -62.6 -52.47 63.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.833 -179.197 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -62.41 -17.68 59.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.62 -179.279 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.407 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 44.9 tp -90.23 -40.94 11.87 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.075 0.464 . . . . 0.0 110.34 179.566 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.791 HD13 ' O ' ' A' ' 14' ' ' PHE . 0.0 OUTLIER -48.86 -45.26 40.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.192 -179.705 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.1 mt -90.06 0.79 56.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.802 -179.482 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -97.92 30.79 2.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.853 0.359 . . . . 0.0 111.003 -179.984 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 92.38 22.86 28.19 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.685 179.929 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.585 ' CD1' HD12 ' A' ' 18' ' ' LEU . 30.2 t80 -110.08 127.06 54.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.843 0.354 . . . . 0.0 110.704 179.845 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.575 ' HB3' HG23 ' A' ' 26' ' ' VAL . 4.9 t0 -68.09 110.35 3.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.888 -179.979 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.547 ' HA ' HD23 ' A' ' 27' ' ' LEU . 11.4 p-10 -61.71 -19.46 62.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.222 179.836 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.66 -20.91 66.09 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.273 179.987 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.575 HG23 ' HB3' ' A' ' 23' ' ' ASP . 21.8 t -82.1 -40.2 17.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.426 -179.752 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.609 HD13 ' CZ ' ' A' ' 14' ' ' PHE . 1.2 pp -56.6 -36.56 69.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.965 -179.777 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.732 ' O ' HD22 ' A' ' 32' ' ' LEU . 11.6 t30 -63.23 -16.2 59.47 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.408 -179.97 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.418 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 57.2 mt-10 -90.12 -35.27 15.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.837 0.351 . . . . 0.0 111.218 -179.716 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 1.051 HG23 HG21 ' A' ' 61' ' ' ILE . 11.8 p -90.5 -32.2 5.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.367 -0.379 . . . . 0.0 112.002 -179.589 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.926 HD12 HG13 ' A' ' 30' ' ' VAL . 1.7 mp -76.49 -48.86 25.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.578 -179.446 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.732 HD22 ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -56.96 -22.43 37.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.683 0.278 . . . . 0.0 111.189 -179.752 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.724 ' N ' HD23 ' A' ' 32' ' ' LEU . 93.5 m -82.68 -28.93 30.29 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.878 0.371 . . . . 0.0 110.808 179.66 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.725 HD21 HD21 ' A' ' 40' ' ' LEU . 12.6 mt -90.12 -23.04 21.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.731 -179.421 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -104.16 20.24 18.67 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -179.176 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.466 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 7.4 mtmt -118.37 -55.85 2.19 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.211 179.79 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.466 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 10.1 pttm 156.29 -20.54 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.035 179.665 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -61.86 111.27 4.2 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.072 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -68.64 163.86 35.35 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.412 2.075 . . . . 0.0 112.117 179.8 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.725 HD21 HD21 ' A' ' 34' ' ' LEU . 5.2 mt -86.44 123.42 31.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.064 179.977 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -61.6 157.26 48.74 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.947 -179.871 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.77 -30.56 49.89 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.616 2.21 . . . . 0.0 112.294 179.875 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.79 -19.47 59.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.01 179.822 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.439 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.1 m-85 -62.69 -16.52 57.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.217 179.983 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 67.44 52.06 0.82 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.923 0.392 . . . . 0.0 110.952 -179.862 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.6 p-10 -88.28 107.69 18.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.787 179.902 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.96 -168.29 3.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.855 -179.965 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -90.8 126.89 36.15 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.143 179.855 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.489 HD21 ' CD ' ' A' ' 58' ' ' GLU . 1.5 mp -64.48 169.01 5.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.895 179.93 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.42 167.75 10.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.09 179.948 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.27 -126.3 7.32 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.559 -179.94 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.03 -5.22 55.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.639 0.257 . . . . 0.0 111.37 179.965 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 6.0 m0 -97.65 29.31 3.39 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.89 0.376 . . . . 0.0 110.966 179.949 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.527 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -66.83 -56.2 14.9 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.407 -179.871 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 19.0 Cg_endo -59.2 -12.65 16.74 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.343 2.029 . . . . 0.0 112.572 -179.994 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.457 ' CD1' HD21 ' A' ' 79' ' ' LEU . 17.7 m-85 -93.71 170.12 9.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.841 0.353 . . . . 0.0 110.865 179.949 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.78 132.95 44.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.793 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.516 ' HG3' HG22 ' A' ' 68' ' ' VAL . 1.8 tt0 -104.76 170.01 8.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.971 -179.961 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.41 ' SG ' HD13 ' A' ' 40' ' ' LEU . 16.3 t -164.94 122.45 1.6 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.764 -179.981 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 10.4 m170 -93.02 84.22 4.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.068 -179.826 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 1.051 HG21 HG23 ' A' ' 30' ' ' VAL . 3.6 mp -64.82 -49.58 79.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.041 0.448 . . . . 0.0 110.811 179.714 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.617 ' HD2' HG22 ' A' ' 61' ' ' ILE . 0.1 OUTLIER -111.03 174.11 2.52 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.476 -179.851 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.412 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 12.9 Cg_exo -69.1 -5.82 16.74 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.617 2.211 . . . . 0.0 112.78 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -150.19 34.18 0.65 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.782 179.941 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.861 ' O ' HD23 ' A' ' 66' ' ' LEU . 88.5 t -133.7 142.68 40.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.94 -179.835 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.861 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.6 OUTLIER -145.97 98.81 3.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.876 179.97 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.739 HD13 ' HE1' ' A' ' 10' ' ' PHE . 1.0 OUTLIER -97.65 113.39 25.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.552 179.983 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.529 ' N ' HD12 ' A' ' 67' ' ' LEU . 60.9 t -85.24 138.07 19.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.255 -179.835 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 31.4 p90 -143.8 147.14 33.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.863 179.781 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.803 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.3 OUTLIER -103.28 157.36 17.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.871 -179.892 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.682 ' H ' HD23 ' A' ' 70' ' ' LEU . 21.6 t -107.81 109.92 30.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.25 -179.929 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.66 165.97 19.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.623 179.8 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -41.88 -32.73 0.44 Allowed 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.378 -179.811 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -163.43 29.9 0.09 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.805 179.757 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -150.0 162.02 41.19 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.7 -179.864 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.2 tp -117.13 137.23 52.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.93 0.395 . . . . 0.0 110.66 179.706 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.819 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.4 pp -128.16 137.75 56.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.245 -179.849 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.547 HD11 HD11 ' A' ' 4' ' ' LEU . 80.0 mt -84.24 119.93 25.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.738 179.788 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.497 HD13 HG12 ' A' ' 68' ' ' VAL . 0.2 OUTLIER -78.32 -68.86 0.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.901 -179.925 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.466 ' HD3' ' HB3' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -163.04 170.26 18.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.917 0.389 . . . . 0.0 111.355 179.826 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.755 HD21 HG13 ' A' ' 65' ' ' VAL . 3.4 tm? -126.91 134.19 50.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.662 179.96 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.565 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -160.39 -168.83 22.87 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.554 179.985 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.1 m -123.85 178.12 5.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.914 0.388 . . . . 0.0 110.732 -179.93 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -60.7 -29.3 69.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.001 -179.857 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.1 t -85.62 -30.43 23.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.035 -179.882 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.53 -71.68 0.4 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.898 -179.827 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.44 HD13 ' HB2' ' A' ' 66' ' ' LEU . 1.0 OUTLIER -63.4 -33.36 75.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.867 179.999 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.811 -179.96 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 120.734 0.302 . . . . 0.0 111.166 . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.2 mt -137.45 163.75 30.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.904 179.978 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.83 165.61 3.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.818 179.969 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.6 tt -133.95 153.8 51.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.996 -179.919 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.765 ' HB2' HG22 ' A' ' 77' ' ' ILE . 7.0 t30 -138.19 -178.11 5.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.806 -179.993 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.612 HD23 HD12 ' A' ' 78' ' ' LEU . 15.4 mt -146.14 133.37 20.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.976 -179.956 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.82 164.34 11.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.796 179.968 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.4 -31.73 72.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.93 -179.96 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.6 p -70.29 -37.31 74.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.92 179.988 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -59.2 -49.74 76.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.894 -179.948 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -64.03 -44.36 92.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.916 -179.995 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.0 mmtt -74.37 -7.67 53.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.526 179.968 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.28 -31.76 16.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.767 0.317 . . . . 0.0 110.962 -179.913 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.753 ' HE2' HD13 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -90.21 -54.9 3.82 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.344 179.944 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -49.46 -32.37 11.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.769 179.474 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.57 -22.35 26.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.86 179.62 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.417 ' O ' ' HB3' ' A' ' 22' ' ' PHE . 2.6 mt -83.77 -49.54 8.99 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 120.943 0.401 . . . . 0.0 110.264 179.682 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.803 HD13 ' HD1' ' A' ' 22' ' ' PHE . 4.3 mm? -47.26 -40.51 16.74 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.398 179.957 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.5 mt -89.54 -0.49 57.54 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.899 -179.405 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -98.52 33.49 2.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.804 0.335 . . . . 0.0 110.782 -179.887 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.66 23.53 53.04 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.331 -179.924 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.803 ' HD1' HD13 ' A' ' 18' ' ' LEU . 26.4 t80 -107.1 115.84 30.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.809 0.338 . . . . 0.0 110.675 -179.868 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.413 ' O ' ' CD1' ' A' ' 22' ' ' PHE . 5.9 t70 -55.1 146.25 18.85 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.193 -179.742 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.522 ' HA ' HD23 ' A' ' 27' ' ' LEU . 3.3 p30 -96.52 -29.22 14.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.048 -179.988 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.1 m -57.62 -40.61 79.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.112 -179.861 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.404 HG12 ' HB3' ' A' ' 23' ' ' ASP . 12.2 p -74.62 -26.85 20.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.332 -179.999 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.753 HD13 ' HE2' ' A' ' 14' ' ' PHE . 0.3 OUTLIER -59.71 -39.98 86.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.829 0.347 . . . . 0.0 110.901 -179.957 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.472 ' O ' ' HB3' ' A' ' 32' ' ' LEU . 32.1 t-20 -50.27 -57.62 7.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.025 -179.759 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.566 ' HA ' HD22 ' A' ' 32' ' ' LEU . 28.8 mt-10 -51.77 -19.83 1.85 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.744 179.952 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.457 HG22 ' HG3' ' A' ' 62' ' ' LYS . 76.6 t -88.94 -74.36 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.836 0.351 . . . . 0.0 111.746 -179.452 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.7 mp -50.77 -45.39 27.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.15 -0.477 . . . . 0.0 112.011 -178.982 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.891 HD23 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -57.05 -34.61 68.41 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 121.001 -0.28 . . . . 0.0 111.061 -179.498 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.891 ' N ' HD23 ' A' ' 32' ' ' LEU . 90.2 m -68.68 -27.11 65.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.796 0.331 . . . . 0.0 110.875 179.88 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 46.7 mt -90.06 -25.73 20.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.414 -179.719 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 20.4 mtp180 -104.17 20.12 18.9 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.278 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.507 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -115.62 -55.85 2.4 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.168 179.886 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.507 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 151.15 -20.43 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.996 0.518 . . . . 0.0 110.882 179.74 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.39 120.6 41.44 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.085 -179.638 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -72.49 -179.34 4.0 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.342 2.028 . . . . 0.0 112.135 179.882 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -123.2 129.28 51.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.84 179.958 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.414 ' HB2' ' CE1' ' A' ' 44' ' ' PHE . 1.9 m-20 -57.41 159.26 9.12 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.115 -179.887 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.75 -10.06 27.0 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.552 2.168 . . . . 0.0 112.471 -179.98 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.33 9.47 23.17 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.339 179.857 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.414 ' CE1' ' HB2' ' A' ' 41' ' ' ASP . 4.1 m-85 -89.43 8.42 30.94 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.292 179.864 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.426 ' HB2' ' CD2' ' A' ' 60' ' ' HIS . 1.2 mp0 60.31 40.0 18.2 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.824 0.345 . . . . 0.0 110.9 179.882 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -82.06 73.08 9.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.844 179.963 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -129.49 172.35 11.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.857 179.947 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -81.62 133.7 35.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.071 -179.946 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.627 HD11 ' HG3' ' A' ' 58' ' ' GLU . 15.4 mt -82.37 176.14 9.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.857 -179.993 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.7 mtpt -114.29 175.66 5.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.924 179.968 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.38 -128.78 13.71 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.5 -179.929 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.1 mmtt -67.98 -26.39 65.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.591 0.234 . . . . 0.0 110.889 179.995 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 5.6 m-90 -97.59 39.38 1.21 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.832 0.349 . . . . 0.0 110.887 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.461 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -75.35 -51.04 3.45 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.205 179.971 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 71.9 Cg_endo -77.73 3.52 6.84 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.32 2.013 . . . . 0.0 112.671 -179.988 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.418 ' HB3' ' CG1' ' A' ' 68' ' ' VAL . 12.4 m-85 -114.21 169.31 9.12 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.796 0.331 . . . . 0.0 110.89 179.904 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.41 ' HG2' ' CZ ' ' A' ' 69' ' ' TYR . 1.0 OUTLIER -128.58 145.22 51.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.947 -179.987 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.627 ' HG3' HD11 ' A' ' 49' ' ' LEU . 1.4 tt0 -102.75 165.78 10.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.909 179.946 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -162.31 116.72 1.83 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.855 179.938 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.426 ' CD2' ' HB2' ' A' ' 45' ' ' GLN . 5.0 m170 -90.68 85.88 6.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.986 179.978 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.587 ' H ' HD12 ' A' ' 61' ' ' ILE . 4.3 mp -59.8 -29.17 42.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.021 -179.978 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.457 ' HG3' HG22 ' A' ' 30' ' ' VAL . 4.7 mtpt -142.61 168.34 13.61 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.77 -179.911 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.403 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 20.3 Cg_exo -65.43 -6.71 14.09 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.643 2.229 . . . . 0.0 112.743 -179.916 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -138.64 25.95 2.57 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.86 179.789 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.402 ' O ' HD23 ' A' ' 66' ' ' LEU . 67.5 t -140.78 140.83 32.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.218 179.945 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 1.082 HD12 HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -157.31 114.86 3.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.485 179.974 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.662 HD12 ' O ' ' A' ' 68' ' ' VAL . 0.2 OUTLIER -121.23 139.43 53.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.039 -179.881 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.662 ' O ' HD12 ' A' ' 67' ' ' LEU . 39.2 t -88.69 147.0 5.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.794 179.841 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.41 ' CZ ' ' HG2' ' A' ' 57' ' ' ARG . 9.0 p90 -148.99 161.08 42.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.115 -179.974 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.802 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.3 OUTLIER -116.06 156.69 25.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.828 179.958 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.659 ' H ' HD23 ' A' ' 70' ' ' LEU . 21.3 t -107.33 99.75 9.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.184 179.951 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.76 170.72 13.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.781 179.947 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -60.43 104.25 0.31 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.809 179.945 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 57.17 20.98 6.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.139 -179.843 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -149.55 138.51 21.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.639 -179.982 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.37 148.33 24.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.867 179.699 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.802 HD11 ' HB2' ' A' ' 70' ' ' LEU . 1.9 pp -139.32 130.8 34.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.331 -179.87 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.612 HD12 HD23 ' A' ' 6' ' ' LEU . 80.0 mt -74.96 148.21 40.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.511 179.677 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.38 -73.58 0.68 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.273 -179.698 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.02 161.52 42.18 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.989 0.423 . . . . 0.0 111.499 -179.8 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.581 ' C ' HD13 ' A' ' 81' ' ' LEU . 3.4 tm? -115.01 131.56 56.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.694 179.881 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.581 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -137.17 -177.75 15.32 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.451 179.931 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.7 m -150.72 178.14 9.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.879 0.371 . . . . 0.0 110.893 179.995 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.0 t-80 -64.04 -27.17 68.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.948 -179.998 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.7 m -87.41 -28.26 22.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.945 179.94 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -85.62 -74.82 0.39 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.015 -179.895 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 1.082 HD12 HD12 ' A' ' 66' ' ' LEU . 41.3 mt -62.08 -41.74 98.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.956 -179.909 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.887 179.982 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.7 tpt . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.699 0.285 . . . . 0.0 111.468 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 40.1 mt -110.21 -178.67 3.57 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.845 0.355 . . . . 0.0 110.885 -179.952 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.34 149.17 22.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.884 179.915 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.408 HD11 HD11 ' A' ' 78' ' ' LEU . 0.6 OUTLIER -115.66 148.15 40.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.956 179.912 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.78 ' HB2' HG22 ' A' ' 77' ' ' ILE . 5.6 t30 -133.46 176.75 8.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.824 179.948 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 54.1 mt -148.98 112.8 5.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.928 179.933 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.3 mmtt -86.89 176.87 7.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.935 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.06 -33.57 68.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.845 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.4 t -67.23 -35.9 80.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.949 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.644 ' HE2' HD13 ' A' ' 67' ' ' LEU . 22.2 t80 -72.06 -31.15 65.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.877 179.933 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -68.99 -40.45 78.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.843 179.976 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.402 ' O ' ' CB ' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -85.73 -9.49 57.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.336 -179.999 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.65 ' O ' HD12 ' A' ' 17' ' ' LEU . 0.7 OUTLIER -90.36 -27.18 19.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.714 0.292 . . . . 0.0 111.008 179.915 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.512 ' CE1' HD21 ' A' ' 18' ' ' LEU . 7.4 t80 -91.23 -69.52 0.73 Allowed 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.334 179.704 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.528 ' HA ' HD12 ' A' ' 18' ' ' LEU . 21.1 t0 -49.19 -50.08 39.69 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.239 179.719 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.402 ' CB ' ' O ' ' A' ' 12' ' ' LYS . 1.5 tpmp? -68.08 -13.52 62.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.205 -179.982 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.65 HD12 ' O ' ' A' ' 13' ' ' ASP . 3.9 mt -90.27 -55.09 3.74 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-O 121.189 0.518 . . . . 0.0 110.013 179.503 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.528 HD12 ' HA ' ' A' ' 15' ' ' ASP . 0.5 OUTLIER -54.57 -25.89 28.99 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.379 179.868 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 74.9 mt -90.08 -35.15 15.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.941 179.954 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -62.56 -23.36 66.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.146 -179.968 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.99 42.62 0.16 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.47 -179.946 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -113.44 123.54 50.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.777 0.323 . . . . 0.0 110.724 179.908 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.649 ' HB3' HG23 ' A' ' 26' ' ' VAL . 2.7 t0 -56.38 103.27 0.1 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.897 179.944 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.462 ' CA ' HD23 ' A' ' 27' ' ' LEU . 5.1 p30 -54.93 -28.71 53.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.026 -179.962 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.13 -27.05 52.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.095 -179.959 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.649 HG23 ' HB3' ' A' ' 23' ' ' ASP . 35.2 t -72.51 -35.74 52.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.261 -179.88 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.497 ' HB2' HD13 ' A' ' 31' ' ' ILE . 1.2 pp -58.54 -36.66 74.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.186 -179.625 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.848 ' O ' HD22 ' A' ' 32' ' ' LEU . 0.9 OUTLIER -58.42 -19.63 37.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.319 -179.798 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -90.06 -37.69 14.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.388 -179.624 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.833 HG13 HD12 ' A' ' 31' ' ' ILE . 14.8 p -90.31 -44.99 14.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 112.162 0.431 . . . . 0.0 112.162 -179.197 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.833 HD12 HG13 ' A' ' 30' ' ' VAL . 1.7 mp -62.25 -51.94 66.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.55 0.214 . . . . 0.0 111.408 -179.506 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.848 HD22 ' O ' ' A' ' 28' ' ' ASN . 0.4 OUTLIER -53.9 -37.24 63.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.716 0.293 . . . . 0.0 111.081 -179.576 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.722 ' H ' HD23 ' A' ' 32' ' ' LEU . 84.8 m -65.88 -37.65 86.71 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.866 0.365 . . . . 0.0 110.598 179.867 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.406 HD11 ' CD2' ' A' ' 67' ' ' LEU . 97.2 mt -72.82 -30.01 63.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.841 179.924 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.4 mtp180 -102.95 20.13 18.11 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.997 -179.983 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.441 ' O ' ' CG ' ' A' ' 37' ' ' LYS . 2.5 mmmt -116.85 19.38 14.43 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.369 -179.899 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.441 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 3.9 pttp 45.77 39.2 4.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.263 -179.957 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -108.07 111.91 61.78 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.731 -179.922 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -67.3 136.87 41.67 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.419 2.079 . . . . 0.0 112.257 179.961 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.479 HD13 ' SG ' ' A' ' 59' ' ' CYS . 27.0 mt -79.45 179.8 7.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.877 179.984 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -112.23 155.71 43.12 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.932 -179.988 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -67.17 -10.93 30.32 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 122.629 2.219 . . . . 0.0 112.537 179.92 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.96 7.23 25.14 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.417 179.937 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -93.47 14.95 17.08 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.585 0.231 . . . . 0.0 111.121 179.89 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 59.25 38.17 23.43 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.868 0.366 . . . . 0.0 110.972 179.89 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -93.55 112.72 24.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.927 179.945 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 24.8 p-80 -163.36 -175.74 4.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.899 -179.981 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.38 129.58 35.0 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.113 179.97 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.424 ' H ' HD12 ' A' ' 49' ' ' LEU . 4.4 mp -74.39 174.63 8.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.829 -179.929 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -102.63 163.58 12.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.895 -179.915 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.25 -137.51 18.51 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.602 -179.92 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.56 -5.07 48.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.649 0.261 . . . . 0.0 111.45 179.965 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 9.5 m0 -97.05 33.2 1.97 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.791 0.329 . . . . 0.0 111.096 -179.955 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.438 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 7.2 tttt -81.44 -51.05 0.89 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.962 179.957 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.448 ' O ' HD11 ' A' ' 70' ' ' LEU . 50.2 Cg_exo -55.46 -18.12 18.59 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.425 2.084 . . . . 0.0 112.367 179.749 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -102.1 177.86 4.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.904 0.383 . . . . 0.0 111.012 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.545 ' O ' HG13 ' A' ' 68' ' ' VAL . 5.7 tpp180 -135.96 139.63 43.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.936 179.984 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.404 ' HB2' HD11 ' A' ' 49' ' ' LEU . 4.6 tt0 -95.95 158.68 15.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.815 179.955 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.479 ' SG ' HD13 ' A' ' 40' ' ' LEU . 2.6 t -160.94 113.41 1.93 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.866 -179.945 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.423 ' ND1' HD22 ' A' ' 66' ' ' LEU . 3.5 m-70 -97.2 89.46 4.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.981 179.928 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.648 HD11 HD23 ' A' ' 67' ' ' LEU . 4.4 mp -55.08 -27.49 19.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.013 179.762 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.441 ' HB2' ' CD ' ' A' ' 63' ' ' PRO . 0.0 OUTLIER -154.77 170.96 7.76 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.551 179.971 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.441 ' CD ' ' HB2' ' A' ' 62' ' ' LYS . 17.0 Cg_exo -67.0 -0.06 4.33 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.689 2.259 . . . . 0.0 113.164 -179.702 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -134.86 25.21 3.64 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.664 0.268 . . . . 0.0 111.157 179.89 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.616 HG13 HD21 ' A' ' 81' ' ' LEU . 58.4 t -155.63 143.63 12.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.004 0.431 . . . . 0.0 111.309 179.913 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.825 HD12 HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -159.13 100.43 1.54 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.693 179.794 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.648 HD23 HD11 ' A' ' 61' ' ' ILE . 0.3 OUTLIER -105.84 151.51 24.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.893 -179.858 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.545 HG13 ' O ' ' A' ' 57' ' ' ARG . 59.0 t -100.53 139.95 20.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.13 -179.914 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.672 ' CD1' HD11 ' A' ' 76' ' ' LEU . 16.9 p90 -145.66 158.48 43.84 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.924 179.912 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.623 ' HB2' HD11 ' A' ' 77' ' ' ILE . 6.7 tp -114.08 157.77 22.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.857 179.866 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -113.75 105.34 18.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.206 -179.919 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 10.6 tptt -76.09 165.73 24.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.666 179.815 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -44.53 -31.87 1.24 Allowed 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.363 -179.942 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -160.4 28.79 0.16 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.787 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -148.55 163.51 36.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.654 179.985 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.672 HD11 ' CD1' ' A' ' 69' ' ' TYR . 10.0 tp -122.52 130.9 53.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.673 179.658 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.78 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.1 pp -122.8 133.35 69.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.349 -179.665 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.408 HD11 HD11 ' A' ' 4' ' ' LEU . 85.7 mt -82.25 126.61 32.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.637 179.648 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.38 -66.21 0.92 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.055 -179.783 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.52 ' HE ' HG21 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -162.13 165.71 26.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.989 0.423 . . . . 0.0 111.478 -179.945 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.702 HD22 ' N ' ' A' ' 82' ' ' GLY . 1.7 tm? -124.7 135.65 53.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.656 -179.913 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.702 ' N ' HD22 ' A' ' 81' ' ' LEU . . . -162.3 -172.19 29.42 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.687 179.932 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.92 -167.97 1.96 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.837 0.351 . . . . 0.0 110.878 -179.915 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -73.54 -27.53 61.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.022 -179.964 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.5 t -86.56 -22.69 26.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.221 -180.0 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -87.28 -69.13 0.7 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.853 0.359 . . . . 0.0 111.041 -179.987 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.825 HD12 HD12 ' A' ' 66' ' ' LEU . 25.4 mt -59.83 -40.68 89.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.025 -179.959 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.892 179.971 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.859 0.361 . . . . 0.0 111.107 . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 62.1 mt -107.23 158.33 17.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.911 179.994 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.69 156.11 17.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.918 179.997 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.442 HD11 HD11 ' A' ' 78' ' ' LEU . 2.2 tt -120.28 143.75 48.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.842 179.939 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.457 ' HB2' HG22 ' A' ' 77' ' ' ILE . 1.5 t-20 -126.7 178.5 5.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.985 -179.929 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 41.0 mt -144.18 123.12 12.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.899 179.965 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.3 mmmt -97.05 174.42 6.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.978 -179.924 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.06 -46.53 80.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.802 179.911 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 t -58.06 -24.11 57.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.934 179.831 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.742 ' HE1' HD13 ' A' ' 67' ' ' LEU . 32.9 t80 -84.23 -26.59 28.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.034 179.976 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -69.51 -28.03 65.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.204 -179.782 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.477 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -90.04 -7.47 53.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.781 -179.745 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.502 ' OD2' ' HA ' ' A' ' 10' ' ' PHE . 18.4 p30 -90.6 -15.97 29.57 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.894 0.378 . . . . 0.0 111.57 -179.811 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.649 ' O ' HD13 ' A' ' 18' ' ' LEU . 8.8 t80 -90.86 -60.21 1.97 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.228 -178.994 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.789 ' HA ' HD22 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -91.6 -41.0 11.01 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.374 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.477 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 2.0 mptm? -69.99 -40.08 75.53 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -178.839 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.407 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 0.9 OUTLIER -59.39 -29.39 67.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.929 0.395 . . . . 0.0 110.214 179.698 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.789 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.3 OUTLIER -62.47 -24.1 67.27 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.116 179.856 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.2 15.11 10.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.393 -179.885 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -123.87 45.0 2.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.818 0.342 . . . . 0.0 110.885 179.873 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 71.21 28.89 69.32 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.328 -179.946 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.468 ' CD1' HD12 ' A' ' 18' ' ' LEU . 8.9 t80 -113.18 140.58 47.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.854 0.359 . . . . 0.0 110.783 -179.93 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.419 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 4.3 t0 -97.49 117.9 32.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.902 179.987 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.821 ' HA ' HD23 ' A' ' 27' ' ' LEU . 2.9 p30 -59.73 -28.73 67.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.237 -179.923 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 25.1 p -54.96 -23.31 18.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.542 -179.83 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.6 t -87.38 -42.71 15.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.765 0.317 . . . . 0.0 111.384 -179.726 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.821 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.4 OUTLIER -59.25 -32.27 69.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.01 -179.833 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -53.51 -31.2 45.07 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.875 -179.986 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -81.63 -23.35 37.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.824 179.696 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 96.2 t -78.08 -73.1 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.023 -179.973 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.6 mp -47.45 -33.57 3.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.865 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.844 HD23 ' N ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -58.86 -55.18 38.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.565 179.72 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.844 ' N ' HD23 ' A' ' 32' ' ' LEU . 99.2 m -58.53 -34.76 71.35 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.945 -179.943 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.0 mt -66.75 -46.79 74.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.841 -179.978 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -96.04 20.15 10.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.084 179.994 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.8 mmtt -97.37 12.67 32.33 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.398 -179.905 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.4 mtmt 61.94 27.42 16.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.778 0.323 . . . . 0.0 110.832 179.964 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.25 123.72 29.17 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.863 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -74.31 150.22 41.44 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.361 2.04 . . . . 0.0 112.379 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.416 HD13 ' SG ' ' A' ' 59' ' ' CYS . 4.8 mt -88.27 128.05 35.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.818 179.996 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.26 158.22 88.07 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.066 -179.953 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.66 -10.33 28.36 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.526 2.15 . . . . 0.0 112.455 179.857 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.1 5.86 27.97 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.316 179.817 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -93.69 17.28 12.12 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-O 120.662 0.267 . . . . 0.0 111.183 179.872 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.421 ' HB2' ' CG ' ' A' ' 60' ' ' HIS . 45.0 mm-40 63.98 30.29 14.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.087 179.882 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -88.68 87.92 7.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.906 -179.962 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 17.8 p-80 -143.45 176.37 9.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.873 179.992 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.26 140.29 46.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.101 -179.959 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.572 HD21 ' OE1' ' A' ' 58' ' ' GLU . 1.4 mt -89.7 174.17 7.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.946 179.884 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.0 mtpm? -109.34 164.6 12.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.946 179.981 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.76 -140.91 22.18 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.513 179.989 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.2 tmtt? -74.02 -8.53 56.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.598 0.237 . . . . 0.0 111.352 -179.974 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 19.7 m-90 -96.51 26.39 4.45 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.762 0.315 . . . . 0.0 111.197 -179.942 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.461 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.2 OUTLIER -74.54 -49.52 4.92 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.002 179.911 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.461 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 43.6 Cg_exo -56.45 -17.65 22.37 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.4 2.067 . . . . 0.0 112.437 179.779 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -110.27 174.45 5.86 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.004 -179.87 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.458 ' O ' HG13 ' A' ' 68' ' ' VAL . 41.5 ttm180 -131.13 154.52 48.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.813 179.923 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.572 ' OE1' HD21 ' A' ' 49' ' ' LEU . 3.4 tt0 -105.03 170.14 8.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.931 -179.928 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.416 ' SG ' HD13 ' A' ' 40' ' ' LEU . 3.5 t -168.5 116.88 0.7 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.738 179.997 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.609 ' CD2' HD22 ' A' ' 66' ' ' LEU . 11.1 m170 -95.32 89.08 5.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.993 -179.938 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.582 ' H ' HD12 ' A' ' 61' ' ' ILE . 4.2 mp -66.25 -29.88 48.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.903 179.778 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 16.8 mttt -136.68 171.79 8.08 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.78 179.966 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -68.18 -3.12 10.14 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.663 2.242 . . . . 0.0 112.906 -179.984 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -147.23 30.39 0.94 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.785 179.82 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.814 ' O ' HD23 ' A' ' 66' ' ' LEU . 58.8 t -138.37 144.13 31.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.277 179.88 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.814 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.6 OUTLIER -149.8 108.44 3.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.771 -179.975 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.742 HD13 ' HE1' ' A' ' 10' ' ' PHE . 0.1 OUTLIER -108.69 133.54 52.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.001 0.429 . . . . 0.0 110.989 -179.957 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.49 ' N ' HD12 ' A' ' 67' ' ' LEU . 97.4 t -94.7 140.96 15.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.724 179.751 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.479 ' CD2' HD21 ' A' ' 76' ' ' LEU . 3.1 p90 -146.06 168.48 20.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.905 179.945 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.769 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.3 OUTLIER -125.64 -178.01 4.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.95 -179.822 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.7 t -128.27 115.81 39.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.075 179.871 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -99.51 -178.42 3.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.862 179.99 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -66.28 103.54 1.03 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.854 -179.898 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 56.82 22.73 7.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.14 179.984 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -155.28 136.34 13.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.819 -179.975 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.479 HD21 ' CD2' ' A' ' 69' ' ' TYR . 4.5 tp -93.93 154.4 17.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.878 -179.992 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.769 HD11 ' HB2' ' A' ' 70' ' ' LEU . 1.9 pp -138.27 132.92 42.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.266 -179.94 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.54 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 55.4 mt -81.33 142.06 33.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.566 179.686 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.413 HD12 ' HD3' ' A' ' 80' ' ' ARG . 0.2 OUTLIER -99.71 -71.12 0.71 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.279 -179.63 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.413 ' HD3' HD12 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -157.36 161.08 39.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.011 0.434 . . . . 0.0 111.498 -179.587 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.541 ' C ' HD13 ' A' ' 81' ' ' LEU . 3.2 tm? -112.51 125.33 54.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.566 179.94 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.522 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -136.27 -161.91 9.31 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.66 -179.918 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.4 p -150.57 -177.75 6.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.904 0.383 . . . . 0.0 110.846 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -66.77 -27.98 68.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.995 179.991 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -87.36 -24.97 24.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.193 -179.96 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.15 -73.63 0.43 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.897 -179.888 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.63 HD12 ' HB2' ' A' ' 66' ' ' LEU . 23.3 mt -61.32 -41.08 96.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.93 -179.96 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.213 -0.898 . . . . 0.0 110.868 -179.952 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 120.717 0.294 . . . . 0.0 111.485 . . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 mt -83.11 -175.79 6.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.915 0.388 . . . . 0.0 110.84 179.995 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.79 155.91 12.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.836 179.98 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.79 147.46 46.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.993 -179.936 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.744 ' HB2' HG22 ' A' ' 77' ' ' ILE . 1.2 t-20 -133.33 177.62 7.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.849 179.91 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.8 mp -143.48 132.55 22.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.969 179.968 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.429 ' HE2' HD13 ' A' ' 77' ' ' ILE . 30.1 mmtm -107.39 158.91 16.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.806 180.0 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.3 mttp -61.77 -32.67 72.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.765 179.955 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 88.8 p -63.57 -23.31 67.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.153 179.925 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.59 ' HE1' HD13 ' A' ' 67' ' ' LEU . 53.8 t80 -78.14 -32.07 50.16 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.085 -179.811 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -70.06 -47.88 60.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.128 -179.905 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -75.21 -6.49 49.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.556 -179.959 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.538 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -90.83 -22.6 20.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.976 179.937 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.666 ' CZ ' HD22 ' A' ' 27' ' ' LEU . 43.6 t80 -90.81 -70.85 0.66 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.552 -179.74 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -49.72 -35.81 23.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.212 -179.871 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.481 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 4.5 tppt? -76.57 -20.89 56.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.981 179.88 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.664 HD11 ' OE1' ' A' ' 86' ' ' GLU . 1.6 mt -89.61 -52.21 5.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.951 0.405 . . . . 0.0 110.151 179.187 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.631 HD13 ' HD2' ' A' ' 22' ' ' PHE . 4.3 mm? -49.2 -32.43 10.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.536 -179.771 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.55 ' C ' HD12 ' A' ' 19' ' ' LEU . 4.4 pp -89.65 -8.22 52.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.708 -179.629 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -96.6 40.11 1.14 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.846 0.355 . . . . 0.0 110.846 -179.954 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 70.01 27.6 72.82 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.495 -179.936 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.631 ' HD2' HD13 ' A' ' 18' ' ' LEU . 67.6 t80 -95.35 128.14 41.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.827 0.346 . . . . 0.0 110.81 -179.95 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.405 ' HB3' HG23 ' A' ' 26' ' ' VAL . 0.7 OUTLIER -56.98 119.6 6.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.915 -179.97 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.542 ' HA ' HD23 ' A' ' 27' ' ' LEU . 9.0 p-10 -82.59 -34.84 27.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.157 -179.796 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.68 -22.62 47.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.257 -179.929 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.405 HG23 ' HB3' ' A' ' 23' ' ' ASP . 21.3 t -82.48 -35.06 12.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.392 -179.871 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.666 HD22 ' CZ ' ' A' ' 14' ' ' PHE . 0.8 OUTLIER -56.98 -36.45 70.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.107 -179.69 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.404 ' N ' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -62.77 -23.36 67.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.269 -179.798 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -80.04 -33.82 38.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.138 -179.814 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.723 HG13 HD12 ' A' ' 31' ' ' ILE . 11.7 p -89.96 -43.3 14.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.262 -179.879 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.723 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -64.75 -24.7 36.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.871 179.853 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.706 HD23 ' N ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -70.84 -46.85 61.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.15 -179.844 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.706 ' N ' HD23 ' A' ' 32' ' ' LEU . 55.8 m -62.81 -25.98 68.51 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.42 -179.473 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.0 mt -90.04 -35.72 15.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.73 0.3 . . . . 0.0 111.544 -179.478 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.17 20.23 7.14 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.335 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.472 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 3.2 mttm -118.43 -55.96 2.18 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.054 179.724 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.472 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 2.3 pttt 154.65 -20.41 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.0 179.565 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.66 ' HB3' HG23 ' A' ' 33' ' ' THR . 0.0 OUTLIER -65.31 120.72 70.02 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.163 -179.627 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.51 -178.74 4.7 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.476 2.118 . . . . 0.0 112.289 179.832 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.62 HD13 ' SG ' ' A' ' 59' ' ' CYS . 59.3 mt -92.31 108.66 20.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.929 179.843 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -58.74 161.6 8.16 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.98 -179.927 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -67.14 -33.25 31.93 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.461 2.107 . . . . 0.0 112.189 179.915 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -58.9 -21.07 56.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.106 179.854 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.432 ' CE2' ' HA ' ' A' ' 61' ' ' ILE . 3.5 m-85 -57.42 -21.78 38.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.136 179.961 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 64.44 66.57 0.6 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.988 0.423 . . . . 0.0 110.963 179.999 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -93.29 106.17 18.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.861 179.911 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 42.1 m80 -124.2 175.5 7.0 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.929 179.972 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -99.31 114.55 27.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.132 -179.967 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.657 HD11 ' HG3' ' A' ' 58' ' ' GLU . 3.3 mt -61.56 159.13 13.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.837 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.66 165.74 11.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.107 -179.928 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 58.39 108.21 0.01 OUTLIER Glycine 0 CA--C 1.507 -0.429 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.809 179.754 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.4 mptt 69.14 -46.15 0.56 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.628 0.252 . . . . 0.0 111.161 179.815 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 22.6 m95 -97.03 32.14 2.22 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.994 -179.894 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.434 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.2 OUTLIER -69.3 -51.86 16.47 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.087 179.891 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.434 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 98.9 Cg_endo -80.21 46.24 2.19 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.437 2.091 . . . . 0.0 112.522 179.933 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -156.52 175.66 13.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.852 0.358 . . . . 0.0 110.88 179.849 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.655 ' O ' HG13 ' A' ' 68' ' ' VAL . 14.7 ttm105 -137.79 144.04 41.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.919 -179.942 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.657 ' HG3' HD11 ' A' ' 49' ' ' LEU . 1.1 tt0 -105.35 177.31 4.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.975 -179.895 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.62 ' SG ' HD13 ' A' ' 40' ' ' LEU . 0.5 OUTLIER -168.26 126.09 1.12 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.68 -179.992 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.467 ' CE1' HD22 ' A' ' 66' ' ' LEU . 2.6 m-70 -102.19 82.69 2.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.07 -179.734 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.713 HG21 HG23 ' A' ' 30' ' ' VAL . 4.4 mp -59.99 -26.94 37.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.771 179.662 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.426 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 23.5 mtpp -139.82 169.25 12.51 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.566 179.927 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.426 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 12.2 Cg_exo -70.04 -0.19 6.78 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.802 2.335 . . . . 0.0 112.983 -179.86 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -143.33 27.61 1.55 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.875 179.877 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.83 ' O ' HD23 ' A' ' 66' ' ' LEU . 38.9 t -139.51 152.06 22.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.938 0.399 . . . . 0.0 111.311 179.992 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.83 HD23 ' O ' ' A' ' 65' ' ' VAL . 1.0 OUTLIER -148.17 100.54 3.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.552 179.804 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.775 HD12 ' N ' ' A' ' 68' ' ' VAL . 4.2 tp -97.48 131.32 44.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.059 -179.679 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.775 ' N ' HD12 ' A' ' 67' ' ' LEU . 57.1 t -106.14 136.75 39.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.891 179.793 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.612 ' CE1' HD11 ' A' ' 76' ' ' LEU . 45.3 p90 -153.55 164.04 38.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.136 -179.921 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.736 ' HB2' HD11 ' A' ' 77' ' ' ILE . 1.4 tp -106.39 174.46 5.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.864 179.916 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.4 t -123.86 123.23 66.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.26 -179.957 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 3.7 tptp -100.15 160.97 13.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.743 179.919 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -44.27 -49.46 9.35 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.54 -179.81 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -137.89 28.3 2.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.919 179.927 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 50.6 mp0 -156.88 170.0 23.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.824 179.96 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.612 HD11 ' CE1' ' A' ' 69' ' ' TYR . 0.7 OUTLIER -129.88 141.15 50.85 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.682 179.803 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.744 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.3 pp -128.95 131.55 68.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.396 -179.724 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 72.5 mt -73.43 158.44 34.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.599 179.77 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.84 -78.33 0.58 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.045 -179.885 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.72 167.06 29.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.013 0.435 . . . . 0.0 111.253 -179.909 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.868 HD13 ' N ' ' A' ' 82' ' ' GLY . 1.5 tm? -114.19 137.72 51.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.696 179.849 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.868 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -141.26 -176.32 15.52 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.675 -179.775 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -140.88 -176.15 4.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.812 0.339 . . . . 0.0 110.895 179.985 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -67.75 -27.78 67.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.167 -179.949 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.2 m -90.02 -27.57 19.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.099 -179.97 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.664 ' OE1' HD11 ' A' ' 17' ' ' LEU . 1.1 mt-10 -80.18 -75.11 0.27 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.842 0.353 . . . . 0.0 111.015 -179.798 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.552 HD12 ' HB2' ' A' ' 66' ' ' LEU . 29.6 mt -67.17 -38.43 85.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.023 -179.943 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.192 -0.908 . . . . 0.0 111.027 179.92 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.819 0.343 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 10.3 mt -96.34 161.95 13.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.92 179.905 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -66.56 160.89 24.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.819 179.987 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.9 tt -128.64 144.96 51.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.905 179.781 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.755 ' HB2' HG22 ' A' ' 77' ' ' ILE . 0.9 OUTLIER -141.48 163.33 33.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.859 -179.925 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.6 mp -124.63 125.55 44.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.858 179.998 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.604 ' HE3' HD13 ' A' ' 77' ' ' ILE . 58.8 mmtt -92.12 168.86 11.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.942 -179.969 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -60.33 -32.23 71.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.782 -179.97 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.3 m -70.83 -47.49 59.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.821 179.936 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.479 ' HE1' HD13 ' A' ' 67' ' ' LEU . 31.3 t80 -63.86 -30.7 71.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.959 -179.833 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -63.23 -46.16 88.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.996 -179.916 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.5 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 7.4 pttt -87.08 -5.6 58.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.597 -179.955 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.428 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -90.77 -15.74 29.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.082 179.778 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.889 ' O ' HD13 ' A' ' 18' ' ' LEU . 21.1 t80 -90.82 -74.33 0.5 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.633 -179.474 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.681 ' HA ' HD22 ' A' ' 18' ' ' LEU . 1.1 m-20 -79.65 -32.93 41.65 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -178.899 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.5 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.4 OUTLIER -75.41 -16.57 60.34 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.213 -179.656 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.428 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 32.7 tp -90.14 -37.41 14.22 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.402 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.889 HD13 ' O ' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -50.9 -42.95 59.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.066 179.962 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.5 pp -89.28 0.72 56.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.691 -179.531 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -98.05 32.07 2.52 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.741 0.305 . . . . 0.0 110.85 -179.965 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.79 22.97 40.54 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.503 -179.843 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.579 ' CD1' HD12 ' A' ' 18' ' ' LEU . 34.2 t80 -106.99 141.71 37.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.803 0.335 . . . . 0.0 110.769 179.834 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.889 ' O ' HG12 ' A' ' 26' ' ' VAL . 16.0 t70 -78.89 105.58 10.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.829 179.954 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.594 ' HA ' HD23 ' A' ' 27' ' ' LEU . 27.3 p30 -64.92 -14.26 59.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.455 -179.954 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.1 t -75.84 -20.99 57.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.606 0.241 . . . . 0.0 111.47 -179.866 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.889 HG12 ' O ' ' A' ' 23' ' ' ASP . 14.3 p -88.8 -27.14 5.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.71 0.291 . . . . 0.0 111.614 -179.633 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.609 HD13 ' HE1' ' A' ' 14' ' ' PHE . 1.5 pp -59.11 -37.92 78.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.84 0.352 . . . . 0.0 110.956 -179.855 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -56.89 -24.96 55.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.192 -179.842 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -78.73 -44.73 22.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.152 -179.964 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.532 HG13 HD12 ' A' ' 31' ' ' ILE . 11.5 p -80.58 -48.96 19.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.313 -179.857 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.532 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -54.0 -34.56 26.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 121.08 0.467 . . . . 0.0 110.228 179.45 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.817 HD23 ' N ' ' A' ' 33' ' ' THR . 0.9 OUTLIER -52.08 -61.34 2.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.317 179.471 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.817 ' N ' HD23 ' A' ' 32' ' ' LEU . 39.1 m -54.23 -26.81 30.64 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.564 -179.867 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 32.8 mt -70.44 -49.51 47.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.758 0.313 . . . . 0.0 111.149 -179.766 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.1 mtm180 -77.35 -55.89 5.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.99 0.424 . . . . 0.0 110.806 -179.802 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.736 ' HE2' HD21 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -64.12 -16.7 62.38 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.599 -179.967 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.553 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 0.2 OUTLIER 53.35 73.06 0.39 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.332 179.807 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.672 ' HB3' HG23 ' A' ' 33' ' ' THR . 20.4 tt0 -84.11 139.09 39.42 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.138 178.781 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -58.56 105.0 0.2 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.451 2.101 . . . . 0.0 112.034 179.894 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 50.1 mt -62.48 178.78 0.38 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.013 -179.777 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -140.14 163.52 43.52 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.779 -179.985 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -64.24 -27.91 64.19 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.602 2.202 . . . . 0.0 112.291 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.25 -17.92 64.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.247 179.942 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.426 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.6 m-85 -69.49 -10.7 59.17 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.48 -179.988 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 61.89 36.89 15.63 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.893 0.378 . . . . 0.0 110.902 -179.959 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.2 p-10 -75.77 84.42 2.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.879 179.789 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 -140.48 -177.61 5.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.061 -179.921 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.9 157.23 33.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.162 -179.945 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.58 HD11 ' HG3' ' A' ' 58' ' ' GLU . 53.9 mt -105.3 -178.35 3.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.913 180.0 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -118.08 175.17 5.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.91 -179.879 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 71.81 -138.19 26.73 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.546 -179.954 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.18 -28.19 69.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.694 0.283 . . . . 0.0 111.0 179.98 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 8.1 m95 -97.32 39.26 1.2 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.726 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.462 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 3.1 tmtp? -69.51 -51.38 16.65 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.314 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.462 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 81.9 Cg_endo -78.67 6.6 4.75 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.449 2.1 . . . . 0.0 112.878 -179.787 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -105.39 173.38 6.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.842 0.354 . . . . 0.0 110.87 179.93 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.611 ' O ' HG13 ' A' ' 68' ' ' VAL . 23.1 ttm180 -131.74 142.9 49.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.979 -179.967 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.58 ' HG3' HD11 ' A' ' 49' ' ' LEU . 1.2 tt0 -110.75 171.67 7.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.985 -179.914 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 8.3 t -160.78 118.47 2.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.719 179.882 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.591 ' CE1' HD22 ' A' ' 66' ' ' LEU . 3.8 m-70 -94.4 78.7 3.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.977 -179.858 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.524 ' CB ' HG23 ' A' ' 30' ' ' VAL . 3.7 mp -57.06 -27.12 26.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.072 179.76 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.558 ' NZ ' HG22 ' A' ' 26' ' ' VAL . 10.5 mtmm -139.37 169.26 12.71 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.708 179.991 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.402 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 13.7 Cg_exo -69.19 -3.32 11.4 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.78 2.32 . . . . 0.0 112.875 -179.834 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -141.29 26.02 2.02 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.922 179.881 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.845 ' O ' HD23 ' A' ' 66' ' ' LEU . 56.9 t -136.64 147.11 27.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.173 179.97 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.845 HD23 ' O ' ' A' ' 65' ' ' VAL . 2.4 mt -144.31 97.98 3.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.647 179.846 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.743 HD12 ' N ' ' A' ' 68' ' ' VAL . 4.2 tp -94.15 127.81 40.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.979 -179.865 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.743 ' N ' HD12 ' A' ' 67' ' ' LEU . 46.6 t -105.08 136.35 39.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.727 179.769 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -147.89 153.67 39.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.054 179.964 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.773 ' HB2' HD11 ' A' ' 77' ' ' ILE . 3.6 tp -99.18 173.13 6.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.893 -179.995 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.424 ' HA ' HD12 ' A' ' 76' ' ' LEU . 21.5 t -123.68 102.94 12.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.181 -179.966 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 13.5 tptp -73.48 162.32 29.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.758 179.962 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -44.95 -43.33 8.92 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.376 -179.86 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -145.4 29.72 1.14 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.819 179.902 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.3 mp0 -157.39 167.99 28.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.802 -179.885 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.424 HD12 ' HA ' ' A' ' 71' ' ' VAL . 10.8 tp -120.19 139.13 53.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.797 179.902 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.773 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.3 pp -128.83 131.6 68.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.339 -179.806 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 71.9 mt -73.68 137.14 43.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.704 179.742 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.09 -72.01 0.63 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.021 -179.767 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.447 ' NH2' HG11 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -161.16 170.48 20.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.849 0.357 . . . . 0.0 111.32 -179.949 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.617 HD13 ' N ' ' A' ' 82' ' ' GLY . 1.9 tm? -122.77 125.33 45.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.93 -179.943 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.617 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -135.43 -162.11 9.56 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.464 179.93 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -148.08 155.26 41.27 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.125 0.488 . . . . 0.0 110.909 -179.994 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.537 ' HA ' HD11 ' A' ' 66' ' ' LEU . 1.0 OUTLIER -49.07 -28.14 3.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.359 -179.886 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 12.1 t -90.09 -22.13 21.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.152 179.823 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -82.71 -73.56 0.39 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.263 -179.83 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.696 ' CD1' HD12 ' A' ' 66' ' ' LEU . 1.1 mp -51.36 -33.8 31.22 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.289 -179.724 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.27 -0.871 . . . . 0.0 110.873 -179.994 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.423 ' HA ' ' HE3' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 120.809 0.338 . . . . 0.0 111.158 . . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.542 HD13 ' CB ' ' A' ' 76' ' ' LEU . 1.4 pp -164.95 175.73 9.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.873 179.949 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.31 150.89 24.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.913 -179.974 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.3 tp -125.16 138.33 54.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.8 179.923 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.736 ' HB2' HG22 ' A' ' 77' ' ' ILE . 1.1 t-20 -118.58 169.58 9.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.835 -179.954 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 33.3 mt -132.21 112.68 12.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.881 -179.961 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.31 161.68 18.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.908 -179.989 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.7 tptt -61.38 -34.46 75.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.825 -179.985 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 39.3 m -69.69 -32.6 71.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.777 179.958 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -73.52 -38.48 65.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.856 -179.965 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -63.34 -37.58 87.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.802 -179.993 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.577 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 1.8 mttp -83.9 -25.56 30.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.234 0.54 . . . . 0.0 111.055 -179.999 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.466 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 1.2 m-20 -90.9 -9.42 46.31 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.067 179.805 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.829 ' CE1' HD13 ' A' ' 27' ' ' LEU . 47.5 t80 -91.26 -68.02 0.82 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.14 -179.604 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -91.05 -34.59 15.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.806 -179.331 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.577 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -78.68 -15.21 58.75 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.167 -179.48 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.466 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 31.6 tp -80.55 -35.18 34.74 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.957 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.704 HD13 ' CB ' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -64.01 -53.37 51.1 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.914 179.71 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.3 mt -60.08 -36.96 78.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.928 179.984 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -24.9 61.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.948 179.901 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.97 37.88 0.24 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.639 179.915 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.4 ' CB ' ' HG ' ' A' ' 17' ' ' LEU . 76.0 t80 -121.63 163.59 18.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.802 0.334 . . . . 0.0 110.866 -179.987 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -76.13 125.45 29.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.101 -179.854 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.704 ' CB ' HD13 ' A' ' 18' ' ' LEU . 7.6 p-10 -93.26 -15.82 25.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.191 179.741 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.1 m -78.83 -34.69 45.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.787 0.327 . . . . 0.0 111.047 -179.678 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 11.7 p -66.81 -27.38 39.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.389 -179.87 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.829 HD13 ' CE1' ' A' ' 14' ' ' PHE . 1.3 pp -64.78 -37.97 89.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.106 -179.803 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.801 ' O ' HD22 ' A' ' 32' ' ' LEU . 7.3 t-20 -61.52 -26.57 68.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.061 -179.988 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.412 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 2.2 mm-40 -74.81 -33.99 62.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.132 -179.869 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 1.11 HG23 HG21 ' A' ' 61' ' ' ILE . 11.7 p -90.65 -41.08 13.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.923 -179.645 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.699 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -64.12 -54.91 25.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.718 -179.301 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.801 HD22 ' O ' ' A' ' 28' ' ' ASN . 0.8 OUTLIER -50.38 -22.53 1.89 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 -179.073 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.562 ' N ' HD23 ' A' ' 32' ' ' LEU . 38.9 m -90.29 -42.57 10.9 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 120.659 0.266 . . . . 0.0 111.545 -179.725 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.977 HD21 HD21 ' A' ' 40' ' ' LEU . 21.9 mt -80.46 -31.72 37.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.952 -179.023 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.533 ' CD ' HG23 ' A' ' 31' ' ' ILE . 5.9 mtp-105 -91.38 20.39 5.28 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -179.238 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.575 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 0.6 OUTLIER -115.51 -45.67 2.9 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.11 -0.236 . . . . 0.0 111.635 -179.969 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.511 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 1.0 OUTLIER 150.99 -20.59 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 122.883 0.473 . . . . 0.0 111.082 179.55 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.15 112.11 10.67 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.129 -179.64 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.49 152.88 34.44 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.452 2.101 . . . . 0.0 112.177 179.807 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.977 HD21 HD21 ' A' ' 34' ' ' LEU . 4.3 mt -76.68 115.76 16.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.826 -179.993 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.62 164.47 3.99 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.033 -179.864 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.62 -13.17 32.28 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.574 2.183 . . . . 0.0 112.604 179.943 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -83.57 3.61 31.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.407 -179.947 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -95.48 20.16 9.91 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.693 0.282 . . . . 0.0 111.181 179.999 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 58.0 mm-40 58.83 34.24 23.57 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.896 179.927 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.0 p-10 -82.9 114.88 21.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.892 -179.975 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -168.72 178.03 4.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.959 179.991 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.42 148.02 43.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.117 179.981 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.533 HD11 ' CG ' ' A' ' 58' ' ' GLU . 90.7 mt -102.4 -177.11 3.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.834 179.955 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.77 176.33 5.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.867 -179.915 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 67.93 -136.35 30.94 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.577 179.965 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.44 -25.84 68.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.718 0.295 . . . . 0.0 111.094 -179.869 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.435 ' HD1' HG11 ' A' ' 68' ' ' VAL . 18.5 m-90 -96.65 38.77 1.19 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.912 0.387 . . . . 0.0 110.984 -179.956 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.419 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.1 OUTLIER -73.13 -52.21 5.59 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.011 179.947 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 88.4 Cg_endo -83.2 13.89 2.52 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.646 2.231 . . . . 0.0 112.803 179.973 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.411 ' CD2' ' HG ' ' A' ' 79' ' ' LEU . 96.1 m-85 -114.14 179.18 4.03 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.863 0.363 . . . . 0.0 110.999 -179.921 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.593 HH21 HG21 ' A' ' 71' ' ' VAL . 0.0 OUTLIER -131.14 149.8 52.43 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.886 -179.985 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.533 ' CG ' HD11 ' A' ' 49' ' ' LEU . 0.8 OUTLIER -129.91 169.87 14.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.923 -179.963 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.538 ' SG ' HD13 ' A' ' 40' ' ' LEU . 37.5 t -165.04 129.21 2.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.931 -179.951 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -91.84 83.24 5.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.848 179.837 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 1.11 HG21 HG23 ' A' ' 30' ' ' VAL . 3.5 mp -56.91 -50.93 73.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.122 -179.966 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.439 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 0.0 OUTLIER -114.82 172.41 3.64 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.483 179.965 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.439 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 16.7 Cg_exo -67.17 -4.28 11.34 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.554 2.169 . . . . 0.0 112.851 -179.874 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -146.81 29.09 1.02 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.874 179.933 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.791 ' O ' HD23 ' A' ' 66' ' ' LEU . 52.8 t -136.47 145.01 31.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.988 0.423 . . . . 0.0 111.383 179.934 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.791 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.0 OUTLIER -159.13 111.22 2.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.595 179.745 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.488 HD12 ' O ' ' A' ' 68' ' ' VAL . 0.3 OUTLIER -111.68 139.03 47.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.875 0.369 . . . . 0.0 111.103 -179.745 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.488 ' O ' HD12 ' A' ' 67' ' ' LEU . 40.9 t -88.94 139.36 17.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.801 179.84 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.403 ' CD1' ' N ' ' A' ' 69' ' ' TYR . 2.3 p90 -153.84 175.58 13.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.037 -179.952 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.601 ' HB2' HD11 ' A' ' 77' ' ' ILE . 4.5 tp -130.16 150.13 51.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.888 179.979 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.593 HG21 HH21 ' A' ' 57' ' ' ARG . 21.6 t -106.97 111.43 35.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.109 179.988 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.68 168.72 9.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.89 179.963 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.21 108.78 1.14 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.93 -179.922 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.1 t0 57.98 24.2 10.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.069 179.885 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -160.02 141.21 12.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.817 179.989 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.542 ' CB ' HD13 ' A' ' 2' ' ' LEU . 0.5 OUTLIER -119.93 148.16 43.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.896 -179.972 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.736 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.1 pp -131.49 134.32 60.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.26 -179.913 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 62.7 mt -84.93 135.39 34.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.671 179.781 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.411 ' HG ' ' CD2' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -93.73 -61.43 1.55 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.045 -179.927 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.4 175.05 4.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.973 0.416 . . . . 0.0 111.297 179.955 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.873 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.1 tm? -116.13 142.36 46.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.793 -179.971 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.873 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -148.5 -178.02 23.26 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.507 179.966 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 58.7 m -138.45 177.05 8.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.836 0.351 . . . . 0.0 110.907 179.944 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 8.4 t-80 -64.24 -29.99 71.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.943 -179.969 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.9 m -88.49 -29.95 19.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.895 -179.96 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.27 -68.13 0.55 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.886 -179.949 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.753 HD12 HD12 ' A' ' 66' ' ' LEU . 25.3 mt -69.7 -32.68 71.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.931 -179.979 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.938 179.983 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.1 mtm . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.717 0.294 . . . . 0.0 111.531 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 8.0 mt -76.97 176.57 8.51 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.889 0.376 . . . . 0.0 110.927 179.923 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.67 152.69 40.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.957 -179.966 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.444 HD11 HD21 ' A' ' 78' ' ' LEU . 2.7 tp -120.75 145.27 47.69 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.874 179.931 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.485 ' HB2' HG22 ' A' ' 77' ' ' ILE . 8.0 t30 -129.88 171.89 12.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.752 179.957 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.453 HD11 HH21 ' A' ' 35' ' ' ARG . 4.6 mp -140.79 119.97 12.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.829 179.997 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -93.58 -176.56 4.12 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.917 179.973 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.7 mmtt -74.18 -31.36 62.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.863 -179.972 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.57 -39.76 73.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.99 -179.96 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -71.95 -33.24 68.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.885 -179.951 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -59.42 -47.09 86.78 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.989 179.964 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.542 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 0.9 OUTLIER -80.34 -13.45 59.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.12 179.892 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.421 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 3.2 m-20 -90.72 -11.88 38.31 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.037 179.715 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.596 ' O ' HD13 ' A' ' 18' ' ' LEU . 76.6 t80 -90.69 -65.47 1.01 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.214 -179.612 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.782 ' HA ' HD22 ' A' ' 18' ' ' LEU . 1.8 t70 -91.36 -36.34 13.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.95 -179.324 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.542 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 2.0 mptt -72.37 -36.54 68.75 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.125 -179.046 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.548 ' O ' HD23 ' A' ' 17' ' ' LEU . 1.8 tt -61.06 -32.07 71.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.996 0.427 . . . . 0.0 109.908 179.15 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.782 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.2 OUTLIER -62.51 -23.49 66.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.146 179.89 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -90.06 15.05 10.84 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.446 -179.995 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -127.6 47.91 2.32 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.823 0.344 . . . . 0.0 110.844 -179.979 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.27 30.05 65.5 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.482 -179.923 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.523 ' CD1' HD12 ' A' ' 18' ' ' LEU . 8.6 t80 -120.73 124.55 45.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.784 0.326 . . . . 0.0 110.765 -179.921 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.435 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 25.5 t0 -79.53 140.47 37.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.204 -179.744 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.691 ' HA ' HD23 ' A' ' 27' ' ' LEU . 7.3 p-10 -93.68 16.35 14.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.388 -179.977 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.5 t -90.06 -33.51 16.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.76 0.314 . . . . 0.0 111.348 -179.741 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.3 t -84.14 -38.14 13.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.573 -179.623 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.691 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.4 OUTLIER -59.86 -36.6 77.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.16 -179.667 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.529 ' O ' HD12 ' A' ' 32' ' ' LEU . 26.9 t30 -52.23 -46.07 65.57 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.076 -179.927 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.532 ' C ' HD12 ' A' ' 32' ' ' LEU . 5.3 mt-10 -64.94 -16.65 63.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.115 179.794 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 95.2 t -90.36 -74.37 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.034 0.445 . . . . 0.0 111.658 -179.541 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.7 mp -45.72 -44.03 4.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.874 -0.603 . . . . 0.0 112.263 -179.005 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.939 HD13 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -58.56 -19.65 39.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.72 0.295 . . . . 0.0 111.512 -179.431 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.939 ' N ' HD13 ' A' ' 32' ' ' LEU . 99.1 m -84.84 -28.74 25.85 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.83 0.348 . . . . 0.0 111.092 179.996 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.581 HD21 HD11 ' A' ' 40' ' ' LEU . 73.2 mt -89.9 -34.16 16.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.597 -179.349 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.453 HH21 HD11 ' A' ' 6' ' ' LEU . 4.5 mtp-105 -93.31 20.31 7.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.852 -179.346 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.592 ' HE3' HD23 ' A' ' 32' ' ' LEU . 10.3 mttm -110.04 -55.5 2.44 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 121.159 -0.216 . . . . 0.0 110.98 179.719 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.45 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 159.72 -20.53 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.27 179.613 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -83.38 118.33 71.25 Favored Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 116.713 -0.222 . . . . 0.0 111.083 -179.71 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -75.99 -179.39 5.16 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.462 2.108 . . . . 0.0 112.295 179.776 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.581 HD11 HD21 ' A' ' 34' ' ' LEU . 8.7 mt -98.89 157.35 16.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.779 179.968 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -96.56 157.75 34.84 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.024 -179.921 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.29 -3.28 13.68 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.632 2.221 . . . . 0.0 112.817 -179.982 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -92.6 17.71 9.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.694 0.283 . . . . 0.0 111.206 179.858 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -113.46 21.52 15.07 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.744 0.307 . . . . 0.0 110.985 179.901 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 62.79 43.92 6.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.828 179.986 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.7 p-10 -88.75 66.21 7.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.853 179.946 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -120.28 178.3 4.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.882 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.77 163.06 28.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.087 -179.991 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.777 HD21 ' OE1' ' A' ' 58' ' ' GLU . 5.4 mt -106.7 176.76 5.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.886 179.961 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.3 mmtt -116.67 157.07 26.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.041 179.989 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 82.68 -140.22 20.09 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.543 179.978 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm -58.47 -22.92 56.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.737 0.304 . . . . 0.0 111.219 179.999 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 5.0 m95 -96.17 38.48 1.19 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.928 179.953 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.435 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -75.4 -52.19 3.06 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.116 -179.922 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.435 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 90.1 Cg_endo -79.75 47.06 2.4 Favored 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 122.43 2.087 . . . . 0.0 112.347 -179.933 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.721 ' CD1' HD21 ' A' ' 79' ' ' LEU . 77.9 m-85 -154.57 178.37 10.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.856 179.878 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -137.17 134.76 36.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.004 -179.981 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.777 ' OE1' HD21 ' A' ' 49' ' ' LEU . 3.5 tt0 -98.8 171.85 7.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.79 179.891 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.535 ' SG ' HD13 ' A' ' 40' ' ' LEU . 14.8 t -168.36 116.66 0.71 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.901 179.985 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.557 ' CD2' HD22 ' A' ' 66' ' ' LEU . 11.3 m170 -93.31 79.04 4.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.915 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.585 HD11 ' HB3' ' A' ' 67' ' ' LEU . 2.5 mp -55.19 -26.87 19.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.193 179.843 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.425 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 2.7 mtpp -137.72 166.93 22.65 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.767 -179.751 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.425 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 48.2 Cg_endo -68.58 -2.57 9.51 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.351 2.034 . . . . 0.0 112.789 179.929 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -143.47 27.4 1.54 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.662 179.62 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.846 ' O ' HD23 ' A' ' 66' ' ' LEU . 60.9 t -136.9 146.38 28.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.208 -179.956 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.846 HD23 ' O ' ' A' ' 65' ' ' VAL . 5.8 mt -144.24 102.85 3.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.525 179.421 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.725 HD12 ' N ' ' A' ' 68' ' ' VAL . 5.2 tp -102.63 131.42 49.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.141 -179.651 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.725 ' N ' HD12 ' A' ' 67' ' ' LEU . 46.9 t -104.71 138.17 30.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.841 179.843 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.472 ' CD1' HD21 ' A' ' 76' ' ' LEU . 52.5 p90 -157.35 161.59 39.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.063 179.993 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.755 ' HB2' HD11 ' A' ' 77' ' ' ILE . 1.2 tp -109.36 -176.31 2.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.856 180.0 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.439 ' HA ' HD12 ' A' ' 76' ' ' LEU . 21.4 t -127.27 104.82 12.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.137 -179.99 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.62 172.61 8.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.871 179.923 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -57.99 102.55 0.11 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.906 179.893 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 58.17 24.75 11.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.961 -179.899 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -151.53 162.49 40.88 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.803 180.0 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.472 HD21 ' CD1' ' A' ' 69' ' ' TYR . 8.1 tp -123.41 147.66 46.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.832 -179.935 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.755 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.4 pp -131.95 128.92 60.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.154 -179.885 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.444 HD21 HD11 ' A' ' 4' ' ' LEU . 70.1 mt -73.83 155.4 38.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.684 179.744 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.721 HD21 ' CD1' ' A' ' 56' ' ' PHE . 0.3 OUTLIER -117.21 -68.16 0.94 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.94 -179.909 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.81 166.75 29.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.09 179.966 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.836 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.2 tm? -121.27 137.85 54.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.824 -179.952 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.836 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -154.83 -164.67 13.18 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.638 -179.988 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.9 p -142.57 176.67 8.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.892 0.377 . . . . 0.0 110.875 179.997 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 26.7 t-80 -59.27 -27.5 65.87 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.049 -179.904 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.6 m -78.85 -28.89 44.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.087 -179.878 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.412 ' HB3' HD12 ' A' ' 87' ' ' LEU . 1.2 tt0 -84.24 -72.98 0.44 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.023 -179.963 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.46 ' H ' HD12 ' A' ' 87' ' ' LEU . 6.6 mp -60.72 -39.93 90.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.021 -179.964 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.9 -179.961 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.559 HD13 ' HB2' ' A' ' 76' ' ' LEU . 3.2 pp . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.839 0.352 . . . . 0.0 111.073 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.412 ' HD2' ' N ' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -82.36 153.99 25.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.916 -179.875 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.412 ' N ' ' HD2' ' A' ' 3' ' ' LYS . 3.1 tp -121.98 146.3 47.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.842 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.599 ' HB2' HG22 ' A' ' 77' ' ' ILE . 3.6 t30 -136.03 173.68 11.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.861 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.3 mp -144.56 138.02 27.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.981 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.3 mmtp -106.03 171.04 7.56 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.844 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 41.0 tttt -59.23 -30.08 67.99 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.99 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.1 t -70.42 -55.89 7.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.958 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.428 ' HE1' HD13 ' A' ' 67' ' ' LEU . 49.8 t80 -59.08 -33.8 71.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.973 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -60.56 -42.05 95.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.938 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.573 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 3.7 mtpt -89.97 -16.42 29.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.023 0.44 . . . . 0.0 111.464 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -90.75 -11.48 39.41 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.293 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.778 ' O ' HD13 ' A' ' 18' ' ' LEU . 13.9 t80 -90.34 -69.88 0.7 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.806 0.336 . . . . 0.0 111.349 -179.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.776 ' HA ' HD22 ' A' ' 18' ' ' LEU . 5.4 t0 -90.76 -29.6 17.53 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -178.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.573 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.6 OUTLIER -79.0 -17.76 54.81 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.374 -179.284 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.409 ' O ' ' HB3' ' A' ' 22' ' ' PHE . 38.2 tp -87.18 -34.5 19.0 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 179.295 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.778 HD13 ' O ' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -51.78 -49.43 62.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.851 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 pp -84.28 2.48 39.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.708 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.75 32.02 2.74 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.938 0.399 . . . . 0.0 110.781 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.86 22.99 43.59 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.524 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.534 ' CD1' HD12 ' A' ' 18' ' ' LEU . 35.9 t80 -103.77 139.28 39.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.832 0.349 . . . . 0.0 110.709 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.835 ' O ' HG12 ' A' ' 26' ' ' VAL . 45.6 t0 -70.48 97.79 1.35 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.823 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.682 ' HA ' HD23 ' A' ' 27' ' ' LEU . 2.1 p30 -68.56 -12.71 61.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.486 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.2 p -73.96 -24.78 59.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.684 -0.234 . . . . 0.0 111.358 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.835 HG12 ' O ' ' A' ' 23' ' ' ASP . 11.4 p -86.06 -26.2 6.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.465 -179.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.682 HD23 ' HA ' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -64.33 -37.24 86.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.833 0.349 . . . . 0.0 110.899 -179.897 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -55.04 -22.19 14.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.315 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -85.94 -46.8 10.22 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.78 0.324 . . . . 0.0 111.362 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.691 HG13 HD12 ' A' ' 31' ' ' ILE . 9.5 p -75.04 -46.35 40.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.182 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.691 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -66.19 -15.87 19.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.795 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.501 HD23 ' N ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -80.4 -27.87 38.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.257 -179.823 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.501 ' N ' HD23 ' A' ' 32' ' ' LEU . 58.0 m -87.34 -28.02 22.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.74 -179.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.792 HD21 HD21 ' A' ' 40' ' ' LEU . 65.7 mt -90.2 -33.05 16.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.671 -179.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.8 mtp-105 -93.29 20.21 7.31 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.457 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -116.12 -55.94 2.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.583 0.23 . . . . 0.0 111.071 179.673 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.457 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.1 OUTLIER 158.27 -20.48 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.14 179.612 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.87 111.68 9.11 Favored Pre-proline 0 CA--C 1.53 0.182 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.067 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.69 156.8 53.07 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.428 2.085 . . . . 0.0 112.181 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.792 HD21 HD21 ' A' ' 34' ' ' LEU . 67.2 mt -65.66 141.8 58.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.96 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -90.15 155.92 46.67 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.04 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.02 -9.06 24.04 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.636 2.224 . . . . 0.0 112.576 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.66 3.68 31.89 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.473 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -94.41 17.99 12.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.611 0.243 . . . . 0.0 111.255 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 54.97 37.36 28.72 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.784 0.326 . . . . 0.0 110.998 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -77.35 121.44 23.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.057 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -172.95 -170.04 0.62 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.886 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.19 134.24 37.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.048 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.454 HD21 ' HB2' ' A' ' 58' ' ' GLU . 3.9 mp -76.68 177.79 7.26 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.936 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.5 mtmm -113.89 152.65 30.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.891 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.36 -134.92 12.23 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.554 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.99 -13.0 60.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.654 0.264 . . . . 0.0 111.382 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 13.2 m95 -96.56 39.06 1.17 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.796 0.331 . . . . 0.0 110.875 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.461 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 6.9 tttm -69.25 -51.02 18.42 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.47 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 74.6 Cg_endo -78.36 47.88 2.54 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.305 2.003 . . . . 0.0 112.654 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.664 ' CE1' HD21 ' A' ' 79' ' ' LEU . 70.2 m-85 -154.24 170.96 20.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.808 0.337 . . . . 0.0 110.879 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.2 ttm105 -130.46 134.79 47.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.052 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.454 ' HB2' HD21 ' A' ' 49' ' ' LEU . 1.5 tm-20 -108.04 162.6 13.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.952 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 15.0 t -171.09 114.22 0.41 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.771 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.452 ' O ' ' CG ' ' A' ' 60' ' ' HIS . 16.9 p80 -90.18 85.11 6.17 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.077 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.581 HG21 HG23 ' A' ' 30' ' ' VAL . 3.8 mp -53.86 -26.85 14.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.968 179.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.542 ' HB2' HG23 ' A' ' 65' ' ' VAL . 18.3 mmmt -135.57 161.72 61.38 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.443 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.54 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 37.8 Cg_endo -66.16 -2.3 6.72 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.265 1.976 . . . . 0.0 112.89 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -137.99 23.7 2.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.794 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.812 ' O ' HD23 ' A' ' 66' ' ' LEU . 48.3 t -135.71 149.15 27.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.141 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.812 HD23 ' O ' ' A' ' 65' ' ' VAL . 2.1 mt -147.22 85.17 1.59 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.621 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.719 HD12 ' N ' ' A' ' 68' ' ' VAL . 4.9 tp -86.59 127.87 34.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.124 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.719 ' N ' HD12 ' A' ' 67' ' ' LEU . 52.0 t -102.4 138.08 28.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.011 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -151.88 170.74 19.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.954 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.747 ' HB2' HD11 ' A' ' 77' ' ' ILE . 7.8 tp -122.82 151.04 42.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.954 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 28.2 t -102.86 109.6 27.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.125 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.88 173.7 6.19 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.77 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -59.95 103.96 0.26 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.941 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 54.16 24.65 5.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.15 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -150.48 139.58 21.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.875 0.369 . . . . 0.0 110.955 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.559 ' HB2' HD13 ' A' ' 2' ' ' LEU . 6.2 tp -111.16 150.04 30.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.818 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.747 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.2 pp -135.88 130.34 48.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.44 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 80.6 mt -81.24 127.85 33.15 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.624 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.664 HD21 ' CE1' ' A' ' 56' ' ' PHE . 0.0 OUTLIER -88.34 -73.3 0.5 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.055 -179.77 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.455 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -155.92 174.27 15.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.987 -179.883 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.751 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.4 tm? -127.35 139.36 52.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.856 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.751 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -151.55 -176.69 24.59 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.453 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 70.2 m -132.85 167.59 19.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.854 0.359 . . . . 0.0 110.753 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -56.76 -31.16 64.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.923 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.5 m -90.33 -22.7 21.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.325 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.58 -67.54 0.78 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.367 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.526 HD12 ' CD1' ' A' ' 66' ' ' LEU . 25.8 mt -51.33 -26.02 6.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.363 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.885 179.989 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.1 mp . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.912 0.387 . . . . 0.0 110.85 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.43 160.24 7.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.889 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.718 HD21 HD11 ' A' ' 78' ' ' LEU . 0.4 OUTLIER -125.21 155.86 39.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.043 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.811 ' HB2' HG22 ' A' ' 77' ' ' ILE . 0.8 OUTLIER -149.61 -178.08 6.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.944 -179.915 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 21.7 mt -140.23 141.02 35.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.847 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.633 ' HE2' HD13 ' A' ' 77' ' ' ILE . 14.4 mmtm -115.17 171.9 7.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.928 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.3 mtmm -70.19 -33.15 71.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.927 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.48 -34.38 78.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.827 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -66.51 -29.96 70.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.874 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -64.31 -48.61 74.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.6 mtpt -69.92 -24.46 63.38 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.042 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.523 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 7.1 m-20 -90.07 -22.98 21.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.02 0.438 . . . . 0.0 111.049 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.772 ' O ' HD23 ' A' ' 18' ' ' LEU . 73.4 t80 -90.9 -39.21 12.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.55 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -93.05 -58.06 2.44 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.105 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -47.21 68.58 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.57 HD23 ' CB ' ' A' ' 22' ' ' PHE . 3.0 tt -48.17 -39.48 21.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.235 0.54 . . . . 0.0 110.899 -179.136 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.772 HD23 ' O ' ' A' ' 14' ' ' PHE . 2.3 mm? -62.64 -32.43 73.48 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.904 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 19' ' ' LEU . 21.0 mt -90.07 12.73 16.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.301 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -113.86 29.55 7.92 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.874 0.369 . . . . 0.0 110.86 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.23 22.88 46.58 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.796 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.72 ' HD2' HD13 ' A' ' 18' ' ' LEU . 83.4 t80 -113.34 122.93 48.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.923 0.392 . . . . 0.0 110.817 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.417 ' O ' ' CD2' ' A' ' 22' ' ' PHE . 3.4 t0 -58.37 159.66 5.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.867 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.665 ' HA ' HD23 ' A' ' 27' ' ' LEU . 22.7 p-10 -108.69 -29.09 8.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.073 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.3 t -55.5 -23.57 26.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.169 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 20.6 t -79.46 -46.72 22.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.282 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.665 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -58.82 -28.57 66.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.94 -179.874 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -68.23 -15.77 63.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.228 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -90.14 -37.1 14.43 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.344 -179.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.771 HG13 ' CD1' ' A' ' 31' ' ' ILE . 7.5 p -82.49 -34.26 11.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.819 0.342 . . . . 0.0 111.155 -179.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.771 ' CD1' HG13 ' A' ' 30' ' ' VAL . 1.6 mp -76.47 -23.31 15.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.789 179.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.55 HD23 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -74.5 -24.77 59.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.076 -179.962 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.55 ' N ' HD23 ' A' ' 32' ' ' LEU . 89.4 m -90.1 -22.2 21.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.707 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.765 HD21 HD21 ' A' ' 40' ' ' LEU . 12.5 mt -90.45 -42.42 10.88 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 54.9 mtt180 -77.75 -40.27 41.56 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.467 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.2 OUTLIER -53.47 -55.78 22.39 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 121.197 -0.201 . . . . 0.0 111.485 -179.162 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.467 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 157.45 -20.41 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.087 179.736 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.37 123.03 27.45 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.159 -179.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.35 162.95 35.45 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.45 2.1 . . . . 0.0 112.264 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.765 HD21 HD21 ' A' ' 34' ' ' LEU . 83.6 mt -94.43 103.07 15.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.731 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -57.12 153.23 25.74 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.003 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -69.22 -10.35 28.75 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.504 2.136 . . . . 0.0 112.544 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.54 5.84 29.73 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.34 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -84.25 2.91 37.8 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.724 -0.216 . . . . 0.0 111.312 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 61.93 40.15 12.79 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.88 0.372 . . . . 0.0 111.033 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -78.71 87.21 4.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.767 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -120.53 176.06 5.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.038 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.1 175.26 0.54 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.11 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.73 HD11 HG22 ' A' ' 68' ' ' VAL . 0.2 OUTLIER -113.7 -175.74 2.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.775 179.973 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.5 mmtm -135.29 157.61 46.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.879 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.06 -116.61 4.71 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.578 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.62 -24.79 26.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.784 0.326 . . . . 0.0 110.997 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 10.7 m95 -97.43 33.18 2.06 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.879 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.475 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 12.1 tttm -57.73 -50.19 89.49 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.405 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 72.3 Cg_endo -77.3 4.39 5.92 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.323 2.015 . . . . 0.0 113.009 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -106.75 174.84 5.71 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.753 0.311 . . . . 0.0 110.926 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.438 ' O ' HG13 ' A' ' 68' ' ' VAL . 10.1 ttm180 -126.37 150.66 48.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.907 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.478 ' HG3' HD11 ' A' ' 49' ' ' LEU . 6.5 tt0 -111.51 172.16 7.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.893 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.527 ' SG ' HD13 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -156.86 116.71 3.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.788 179.947 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.714 ' CE1' HD22 ' A' ' 66' ' ' LEU . 10.3 m-70 -95.76 80.36 3.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.054 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.697 HD13 ' CG2' ' A' ' 30' ' ' VAL . 3.7 mp -67.23 -38.98 82.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.04 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.432 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 5.0 mttm -122.27 168.3 11.97 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.748 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.432 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 55.3 Cg_endo -69.67 -2.08 9.5 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.322 2.015 . . . . 0.0 112.824 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.9 p30 -144.35 26.88 1.44 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.773 179.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.854 ' O ' HD23 ' A' ' 66' ' ' LEU . 90.6 t -133.28 141.13 45.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.102 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.854 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.0 OUTLIER -157.19 94.06 1.37 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.632 179.749 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.571 HD12 ' O ' ' A' ' 68' ' ' VAL . 0.2 OUTLIER -101.72 136.55 41.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.918 -179.859 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.73 HG22 HD11 ' A' ' 49' ' ' LEU . 38.8 t -84.63 140.79 15.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.011 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.731 ' CD1' HD11 ' A' ' 76' ' ' LEU . 32.0 p90 -143.87 158.76 43.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.889 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.751 ' HB2' HD11 ' A' ' 77' ' ' ILE . 4.5 tp -105.37 164.24 12.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.886 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.2 t -114.55 115.93 51.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.058 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -111.39 170.72 7.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.811 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.5 p-10 -64.47 103.81 0.71 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.817 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.3 t70 60.46 19.53 9.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.198 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -151.34 143.09 23.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.843 0.354 . . . . 0.0 110.848 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.731 HD11 ' CD1' ' A' ' 69' ' ' TYR . 8.2 tt -119.35 139.8 51.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.914 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.811 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.4 pp -122.9 135.54 62.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.177 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.718 HD11 HD21 ' A' ' 4' ' ' LEU . 64.0 mt -76.29 143.03 41.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.75 179.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.4 -70.88 0.75 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.11 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.438 ' NH1' HD21 ' A' ' 87' ' ' LEU . 0.1 OUTLIER -154.57 173.04 16.86 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.95 0.405 . . . . 0.0 111.42 -179.859 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.624 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.4 tm? -112.67 133.62 54.61 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.91 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.624 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -136.25 171.78 22.69 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.427 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 18.1 m -135.16 170.15 16.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.777 0.322 . . . . 0.0 110.898 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -58.99 -29.37 67.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.993 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.4 t -90.01 -28.29 19.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.987 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.28 -71.74 0.37 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.022 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.635 HD12 HD12 ' A' ' 66' ' ' LEU . 13.6 mt -69.33 -34.87 75.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.03 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.242 -0.885 . . . . 0.0 110.901 -179.955 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.9 mt . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.777 0.322 . . . . 0.0 110.918 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.403 ' HD2' ' N ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -52.86 151.36 4.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.044 179.97 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.742 HD11 HD11 ' A' ' 78' ' ' LEU . 7.6 tt -115.73 136.31 53.19 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.9 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.74 ' HB2' HG22 ' A' ' 77' ' ' ILE . 10.2 t30 -119.39 175.34 5.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.853 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 17.8 mt -141.98 114.05 8.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.011 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.8 mmpp? -95.64 -177.91 4.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.876 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.94 -31.2 56.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.847 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.4 -31.24 63.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.922 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -79.42 -30.91 42.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.98 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -59.5 -45.58 91.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.993 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.46 ' HA ' ' CB ' ' A' ' 16' ' ' LYS . 4.0 mttt -82.02 -18.96 41.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.261 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.485 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 6.3 m-20 -90.5 -17.39 27.17 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.083 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.501 ' O ' HD21 ' A' ' 18' ' ' LEU . 88.7 t80 -91.35 -65.48 1.01 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.22 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.453 ' O ' HD12 ' A' ' 19' ' ' LEU . 10.6 t70 -90.86 -45.62 8.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.138 -179.118 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.46 ' CB ' ' HA ' ' A' ' 12' ' ' LYS . 2.9 ttmt -70.55 -14.56 62.55 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.393 -179.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.485 ' HB2' ' HA ' ' A' ' 13' ' ' ASP . 26.6 tp -79.65 -39.12 32.16 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.787 HD13 ' CB ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -68.27 -43.11 78.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.711 179.734 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.453 HD12 ' O ' ' A' ' 15' ' ' ASP . 0.4 OUTLIER -65.51 -34.21 77.73 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.695 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -65.23 -24.62 67.39 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.002 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 133.13 41.93 0.17 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.546 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -124.34 140.67 52.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.802 0.334 . . . . 0.0 110.885 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.527 ' OD2' HG23 ' A' ' 26' ' ' VAL . 2.2 t70 -63.68 114.34 3.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.944 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.787 ' CB ' HD13 ' A' ' 18' ' ' LEU . 7.3 p-10 -72.08 -32.28 66.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.4 t -60.65 -49.84 75.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.383 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.527 HG23 ' OD2' ' A' ' 23' ' ' ASP . 60.1 t -51.46 -35.29 16.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.439 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.598 HD12 HD13 ' A' ' 31' ' ' ILE . 0.4 OUTLIER -66.42 -31.81 72.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.899 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -55.24 -47.24 75.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.931 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.4 ' HA ' HD22 ' A' ' 32' ' ' LEU . 2.6 mt-10 -57.39 -20.97 33.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.135 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.756 HG21 HG11 ' A' ' 65' ' ' VAL . 53.7 t -87.66 -69.4 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.011 0.434 . . . . 0.0 111.203 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.598 HD13 HD12 ' A' ' 27' ' ' LEU . 1.8 mp -48.9 -54.15 5.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.083 -179.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.741 HD23 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -55.27 -23.32 22.28 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.608 0.242 . . . . 0.0 111.281 -179.393 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.741 ' N ' HD23 ' A' ' 32' ' ' LEU . 82.0 m -89.93 -26.22 20.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.757 0.313 . . . . 0.0 111.157 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.718 HD21 HD21 ' A' ' 40' ' ' LEU . 73.0 mt -90.1 -30.49 17.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.402 -179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.419 ' CD ' HG23 ' A' ' 31' ' ' ILE . 38.1 mtm180 -95.17 20.16 9.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.722 -179.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.469 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -113.79 -55.58 2.49 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 121.1 -0.24 . . . . 0.0 111.071 179.966 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.469 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 157.43 -20.6 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.114 179.605 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.96 110.9 3.96 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.01 -179.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.22 147.76 33.55 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.53 2.154 . . . . 0.0 112.248 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.775 HD13 ' SG ' ' A' ' 59' ' ' CYS . 3.7 mt -80.89 111.9 17.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.763 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -57.67 155.32 21.86 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.137 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -67.19 -11.58 32.74 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.616 2.211 . . . . 0.0 112.531 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.94 4.77 28.2 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.405 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -94.72 19.06 10.53 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.189 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 11.3 mp0 60.29 41.33 16.6 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.88 0.371 . . . . 0.0 110.984 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.1 p-10 -88.5 96.52 10.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.851 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 56.4 m80 -143.78 177.52 8.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.895 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.88 167.3 6.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.195 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.671 HD11 ' HG3' ' A' ' 58' ' ' GLU . 6.3 mt -114.49 -179.0 3.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.917 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.3 mtpp -131.27 153.98 48.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.843 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 100.16 -109.07 3.62 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.608 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.3 mmtt -101.58 -23.35 14.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.746 0.307 . . . . 0.0 111.111 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 4.9 m95 -96.07 29.13 2.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.032 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.552 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 1.0 OUTLIER -59.04 -54.65 54.38 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.31 -179.93 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 27.1 Cg_endo -62.73 -10.49 19.92 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.267 1.978 . . . . 0.0 112.507 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.617 ' HD1' HD13 ' A' ' 70' ' ' LEU . 13.6 m-85 -99.52 168.26 10.08 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.802 0.334 . . . . 0.0 110.834 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.608 ' O ' HG13 ' A' ' 68' ' ' VAL . 5.0 ttp180 -120.51 150.05 41.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.922 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.671 ' HG3' HD11 ' A' ' 49' ' ' LEU . 2.0 tt0 -104.14 172.96 6.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.009 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.775 ' SG ' HD13 ' A' ' 40' ' ' LEU . 7.0 t -171.1 105.1 0.23 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.76 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.754 ' ND1' HD22 ' A' ' 66' ' ' LEU . 6.7 m170 -78.53 91.83 4.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.041 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.56 ' H ' HD12 ' A' ' 61' ' ' ILE . 4.1 mp -61.78 -41.33 90.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.957 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.448 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 0.2 OUTLIER -130.45 173.84 5.34 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.488 179.968 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.448 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 18.2 Cg_exo -66.15 -4.95 11.28 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.663 2.242 . . . . 0.0 112.796 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -145.13 29.71 1.17 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.866 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.878 ' O ' HD23 ' A' ' 66' ' ' LEU . 77.3 t -143.41 138.21 26.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.237 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.885 HD12 HD13 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -154.22 110.46 3.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.413 179.664 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.581 HD12 ' N ' ' A' ' 68' ' ' VAL . 0.1 OUTLIER -112.62 133.42 54.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.035 -179.781 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.612 HG22 HD11 ' A' ' 49' ' ' LEU . 37.8 t -91.17 142.68 12.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.785 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.592 ' CD2' HD11 ' A' ' 76' ' ' LEU . 54.2 p90 -154.33 163.3 40.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.855 0.359 . . . . 0.0 111.111 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.617 HD13 ' HD1' ' A' ' 56' ' ' PHE . 7.0 tp -110.4 169.63 8.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.776 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 18.4 t -123.19 109.38 23.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.264 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.16 161.53 18.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.8 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -43.91 -61.61 1.39 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.445 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -123.85 28.3 6.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.905 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.7 mp0 -160.16 174.33 14.42 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.843 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.592 HD11 ' CD2' ' A' ' 69' ' ' TYR . 4.4 tt -136.42 149.06 48.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.736 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.74 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.3 pp -132.4 130.09 59.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.329 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.742 HD11 HD11 ' A' ' 4' ' ' LEU . 52.0 mt -76.46 137.39 39.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.612 179.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.17 -69.05 0.77 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.217 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.66 153.83 23.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.372 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.606 ' C ' HD13 ' A' ' 81' ' ' LEU . 3.2 tm? -113.13 126.96 56.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.667 179.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.72 ' HA3' HD11 ' A' ' 87' ' ' LEU . . . -144.71 -171.48 14.57 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.557 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.465 ' O ' HD12 ' A' ' 87' ' ' LEU . 15.3 t -127.73 171.44 11.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.77 0.319 . . . . 0.0 110.841 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.583 ' HA ' HD11 ' A' ' 66' ' ' LEU . 2.3 t60 -60.33 -29.88 69.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.961 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 37.6 m -81.37 -24.99 36.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.008 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.19 -72.04 0.46 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.998 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.885 HD13 HD12 ' A' ' 66' ' ' LEU . 3.6 mp -63.24 -38.96 93.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.912 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.196 -0.907 . . . . 0.0 110.892 -179.956 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.3 mt . . . . . 0 C--O 1.231 0.132 0 CA-C-O 120.799 0.333 . . . . 0.0 110.997 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.0 tmmm? -71.74 152.11 43.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.867 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.525 HD11 HD11 ' A' ' 78' ' ' LEU . 2.3 tt -122.01 143.52 49.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.931 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.54 ' HB2' HG22 ' A' ' 77' ' ' ILE . 8.1 t30 -128.62 -175.76 3.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.898 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.401 HD11 HH22 ' A' ' 35' ' ' ARG . 2.7 mp -144.43 128.51 17.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.973 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.87 -175.24 2.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.909 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.22 -38.1 43.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.908 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.2 m -68.17 -41.08 82.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.915 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.419 ' CZ ' HD13 ' A' ' 78' ' ' LEU . 20.7 t80 -58.86 -30.46 67.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.938 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -62.86 -46.47 87.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.954 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.565 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 1.2 mmmm -81.92 -20.47 38.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.004 0.43 . . . . 0.0 111.185 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.404 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 20.1 m-20 -90.45 -10.94 41.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.082 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.702 ' O ' HD13 ' A' ' 18' ' ' LEU . 27.7 t80 -90.59 -69.0 0.75 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.875 0.369 . . . . 0.0 111.117 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.775 ' HA ' HD22 ' A' ' 18' ' ' LEU . 2.0 t70 -91.15 -32.71 15.72 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.565 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -76.08 -25.81 55.88 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 120.706 -0.398 . . . . 0.0 111.444 -178.99 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.439 ' O ' ' HB3' ' A' ' 22' ' ' PHE . 0.6 OUTLIER -75.64 -33.23 60.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.017 0.437 . . . . 0.0 110.037 179.182 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.775 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.2 OUTLIER -55.63 -42.55 75.13 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.85 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.542 ' C ' HD12 ' A' ' 19' ' ' LEU . 4.5 pp -83.99 -0.86 53.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.479 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.01 36.24 1.59 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.883 0.373 . . . . 0.0 110.94 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.18 25.8 46.83 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.397 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.441 ' CD1' HD12 ' A' ' 18' ' ' LEU . 11.5 t80 -114.08 130.47 56.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.722 0.296 . . . . 0.0 110.806 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.62 ' HB3' HG23 ' A' ' 26' ' ' VAL . 4.8 t70 -72.71 116.11 12.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.951 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.809 ' HA ' HD23 ' A' ' 27' ' ' LEU . 20.1 p-10 -68.33 -25.07 64.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.14 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.7 m -64.71 -21.15 66.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.296 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.62 HG23 ' HB3' ' A' ' 23' ' ' ASP . 21.8 t -83.93 -40.42 15.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.474 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.809 HD23 ' HA ' ' A' ' 24' ' ' ASP . 1.2 pp -57.78 -36.1 71.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.804 0.335 . . . . 0.0 111.129 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.694 ' O ' HD12 ' A' ' 32' ' ' LEU . 15.1 t-20 -57.36 -20.6 30.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.418 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -84.55 -37.49 21.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.693 0.282 . . . . 0.0 111.34 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.906 HG23 HG21 ' A' ' 61' ' ' ILE . 8.0 p -90.41 -36.62 8.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.849 -179.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.712 HD12 HG13 ' A' ' 30' ' ' VAL . 1.4 mp -71.13 -50.03 44.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.588 -179.262 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.93 HD13 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -57.91 -18.92 26.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.549 0.214 . . . . 0.0 111.462 -179.454 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.93 ' N ' HD13 ' A' ' 32' ' ' LEU . 85.1 m -84.75 -30.85 24.35 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.9 0.381 . . . . 0.0 110.703 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.795 HD21 HD21 ' A' ' 40' ' ' LEU . 66.0 mt -89.55 -30.73 18.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.444 -179.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.401 HH22 HD11 ' A' ' 6' ' ' LEU . 13.4 mtt-85 -93.55 20.18 7.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.774 -179.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.443 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 24.4 mttm -119.47 -55.45 2.12 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.576 0.227 . . . . 0.0 111.024 179.791 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.443 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 159.62 -20.65 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.199 179.751 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -65.89 111.24 5.92 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.028 -179.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.95 -179.97 3.87 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.48 2.12 . . . . 0.0 112.2 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.795 HD21 HD21 ' A' ' 34' ' ' LEU . 44.1 mt -102.44 117.45 34.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.9 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -61.45 157.04 48.77 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.042 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -69.03 -10.28 28.71 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.582 2.188 . . . . 0.0 112.548 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.87 11.19 18.66 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.31 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.443 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.4 m-85 -88.48 5.25 43.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.26 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 63.48 36.73 11.06 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.852 0.358 . . . . 0.0 110.897 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -80.65 110.37 16.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.902 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -148.56 174.76 11.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.846 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -92.44 128.26 38.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.088 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.776 HD11 ' CD ' ' A' ' 58' ' ' GLU . 24.7 mt -78.66 -167.9 1.23 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.847 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.2 mmtm -130.26 164.53 24.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.85 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 79.44 -122.78 5.89 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.456 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.32 -30.23 64.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.842 0.353 . . . . 0.0 110.831 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.469 ' HB3' HD12 ' A' ' 49' ' ' LEU . 33.1 m95 -98.45 27.35 4.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.928 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.517 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -75.94 -50.45 3.14 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.775 -179.678 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.517 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 53.0 Cg_endo -70.75 -3.26 12.31 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.165 1.91 . . . . 0.0 112.905 -179.564 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.431 ' CE2' ' HG2' ' A' ' 55' ' ' PRO . 39.3 m-85 -114.35 167.39 10.75 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.834 0.35 . . . . 0.0 110.749 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 11.1 ttm180 -117.03 141.54 48.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.046 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.776 ' CD ' HD11 ' A' ' 49' ' ' LEU . 1.0 OUTLIER -98.09 171.72 8.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.017 -179.835 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.79 ' SG ' HD13 ' A' ' 40' ' ' LEU . 5.8 t -169.94 122.09 0.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.776 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.434 ' CD2' HD22 ' A' ' 66' ' ' LEU . 23.3 m170 -101.72 87.31 3.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.082 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.906 HG21 HG23 ' A' ' 30' ' ' VAL . 3.5 mp -64.38 -51.2 71.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.871 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.562 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 16.7 mmmt -118.32 167.7 10.96 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.205 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.562 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 55.9 Cg_endo -70.86 1.75 4.84 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.081 1.854 . . . . 0.0 112.899 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -142.17 25.02 1.94 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.778 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.808 ' O ' HD23 ' A' ' 66' ' ' LEU . 44.1 t -140.17 149.75 21.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.177 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.808 HD23 ' O ' ' A' ' 65' ' ' VAL . 5.8 mt -146.41 101.84 3.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.878 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.633 ' HB3' HD11 ' A' ' 61' ' ' ILE . 3.4 tm? -95.09 131.97 40.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.953 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.67 HG22 ' OE1' ' A' ' 58' ' ' GLU . 81.8 t -107.24 110.95 33.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.362 179.107 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.722 ' CE1' HD11 ' A' ' 76' ' ' LEU . 26.9 p90 -124.81 162.65 23.85 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.101 -179.36 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.787 ' HB2' HD11 ' A' ' 77' ' ' ILE . 1.5 tp -118.46 133.36 55.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.867 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.511 HG22 ' N ' ' A' ' 72' ' ' LYS . 7.2 p -74.47 158.52 5.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.046 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.511 ' N ' HG22 ' A' ' 71' ' ' VAL . 1.3 tptt -159.35 171.57 19.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.834 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -59.53 100.09 0.07 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.986 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 52.83 23.94 3.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.238 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -148.88 147.05 28.23 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.833 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.722 HD11 ' CE1' ' A' ' 69' ' ' TYR . 0.5 OUTLIER -121.05 151.59 39.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.92 179.915 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.787 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.2 pp -133.42 130.91 57.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.269 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.525 HD11 HD11 ' A' ' 4' ' ' LEU . 67.7 mt -80.26 124.75 29.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.785 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.42 ' HG ' ' CD1' ' A' ' 56' ' ' PHE . 0.1 OUTLIER -87.24 -62.79 1.42 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.914 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.78 162.74 16.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.933 0.397 . . . . 0.0 111.214 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.883 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.0 tm? -104.56 143.11 33.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.817 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.883 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -147.1 177.5 25.35 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.451 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.3 m -143.05 171.66 13.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.854 0.359 . . . . 0.0 110.984 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -60.55 -29.23 69.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.93 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.4 t -88.89 -25.23 22.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.042 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.7 -68.2 0.72 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.962 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.401 HD12 ' CD1' ' A' ' 66' ' ' LEU . 22.8 mt -70.14 -39.14 75.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.051 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.312 -0.851 . . . . 0.0 110.873 -179.996 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.823 0.344 . . . . 0.0 111.022 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.66 151.75 19.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.818 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.773 HD11 HD11 ' A' ' 78' ' ' LEU . 1.1 tt -116.01 143.73 45.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.979 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.797 ' HB2' HG22 ' A' ' 77' ' ' ILE . 0.9 OUTLIER -123.6 -177.52 3.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.863 179.97 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -142.1 118.31 10.75 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.837 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -95.47 174.08 7.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.859 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 44.5 mttt -74.21 -41.84 60.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.825 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.1 p -66.66 -31.32 71.92 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.812 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -75.0 -33.86 61.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.833 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -65.0 -38.64 91.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.806 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.569 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 8.9 pttt -81.65 -25.83 35.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.094 0.473 . . . . 0.0 110.994 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.486 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 6.7 m-20 -90.66 -13.45 34.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.068 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.531 ' O ' HD21 ' A' ' 18' ' ' LEU . 20.5 t80 -91.7 -62.04 1.51 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.105 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.09 -43.67 9.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.287 -179.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.569 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 28.5 mttm -73.31 -17.08 61.35 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 120.908 -0.317 . . . . 0.0 111.477 -178.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.486 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 21.5 tp -76.79 -37.82 55.11 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.487 -0.561 . . . . 0.0 109.487 179.188 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.83 HD13 ' CB ' ' A' ' 24' ' ' ASP . 0.4 OUTLIER -67.16 -33.08 74.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.853 179.85 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.0 mt -74.9 -35.55 62.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.84 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.39 -22.69 67.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.099 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 133.09 41.03 0.19 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.463 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.405 ' CB ' ' HG ' ' A' ' 17' ' ' LEU . 32.6 t80 -124.04 144.31 49.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.868 0.366 . . . . 0.0 110.861 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.606 ' HB3' HG12 ' A' ' 26' ' ' VAL . 5.0 t0 -69.24 122.55 19.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.017 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.83 ' CB ' HD13 ' A' ' 18' ' ' LEU . 28.4 p-10 -78.94 -27.63 43.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.201 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.8 -56.15 13.46 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.399 -179.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.606 HG12 ' HB3' ' A' ' 23' ' ' ASP . 14.5 p -49.37 -28.48 3.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.629 -179.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.664 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -72.88 -33.26 65.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.9 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -55.28 -50.72 68.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.002 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -59.17 -23.92 62.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.094 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.527 ' CG1' HD13 ' A' ' 61' ' ' ILE . 91.1 t -77.72 -72.2 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.105 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.405 HG23 ' HG3' ' A' ' 35' ' ' ARG . 1.5 mp -49.37 -27.48 2.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.229 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.64 HD23 ' N ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -67.68 -36.4 80.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.858 179.852 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.64 ' N ' HD23 ' A' ' 32' ' ' LEU . 61.9 m -70.59 -27.62 64.24 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.497 -179.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.435 ' CD2' HD11 ' A' ' 40' ' ' LEU . 21.3 mt -90.26 -29.51 18.11 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.669 -179.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.577 ' HD2' HD13 ' A' ' 4' ' ' LEU . 10.8 mtp180 -97.09 20.21 11.67 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -179.275 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.495 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.5 OUTLIER -121.38 -55.83 1.92 Allowed 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 121.022 -0.271 . . . . 0.0 111.086 179.746 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.495 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 6.1 pttm 152.04 -20.44 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.036 0.534 . . . . 0.0 110.949 179.605 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.528 ' HB3' HG23 ' A' ' 33' ' ' THR . 1.3 tt0 -63.56 114.79 14.34 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.993 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.53 -179.67 4.32 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.416 2.078 . . . . 0.0 112.146 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.75 HD22 ' SG ' ' A' ' 59' ' ' CYS . 5.5 mp -108.33 142.71 38.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.962 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.06 157.88 74.23 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.107 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.66 -10.02 25.92 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.612 2.208 . . . . 0.0 112.663 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.19 20.6 8.96 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.142 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.538 ' HD2' HD23 ' A' ' 40' ' ' LEU . 8.4 m-30 -104.14 8.48 36.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.218 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 59.42 37.26 23.21 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.875 0.369 . . . . 0.0 110.878 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.3 p-10 -79.26 104.26 9.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.874 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -169.18 176.94 5.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.876 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.31 148.16 48.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.001 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.54 HD21 ' CD ' ' A' ' 58' ' ' GLU . 4.2 mt -96.85 178.78 5.18 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.825 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 11.6 ptpt -112.88 179.27 4.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.986 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 67.1 -145.17 45.94 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.601 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 9.4 mmtm -59.94 -20.45 57.52 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.638 0.256 . . . . 0.0 111.105 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 8.7 m95 -96.81 39.28 1.18 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.992 0.425 . . . . 0.0 110.827 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.44 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.8 OUTLIER -70.19 -49.14 18.66 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.426 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.44 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 86.2 Cg_endo -83.1 37.64 0.68 Allowed 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.572 2.181 . . . . 0.0 113.031 -179.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.492 ' CE1' HD21 ' A' ' 79' ' ' LEU . 20.9 m-85 -136.4 172.65 12.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.698 179.651 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 27.0 ttm105 -136.14 135.17 39.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.844 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.54 ' CD ' HD21 ' A' ' 49' ' ' LEU . 1.4 tt0 -96.0 167.63 11.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.892 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.75 ' SG ' HD22 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -166.56 111.93 0.8 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.807 179.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.405 ' N ' ' CD2' ' A' ' 60' ' ' HIS . 12.1 m170 -91.29 85.15 5.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.003 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.666 HG13 HD21 ' A' ' 40' ' ' LEU . 3.8 mp -58.51 -29.66 39.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.013 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.41 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 29.2 mttt -139.71 162.81 48.9 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.604 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.41 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 31.3 Cg_endo -63.71 -8.12 14.64 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.312 2.008 . . . . 0.0 112.77 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -133.3 26.52 4.15 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.591 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.878 ' O ' HD23 ' A' ' 66' ' ' LEU . 60.6 t -142.72 145.44 23.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.168 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.878 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.2 OUTLIER -148.46 97.76 2.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.646 179.707 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.762 HD22 ' N ' ' A' ' 68' ' ' VAL . 1.4 tm? -91.79 135.4 33.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.01 0.434 . . . . 0.0 111.1 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.762 ' N ' HD22 ' A' ' 67' ' ' LEU . 97.7 t -108.1 124.89 64.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.889 178.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.9 ' CD1' HD11 ' A' ' 76' ' ' LEU . 13.6 p90 -137.27 153.78 50.26 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.224 -179.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.719 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.9 OUTLIER -112.55 131.9 55.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.946 -179.997 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.523 HG22 ' N ' ' A' ' 72' ' ' LYS . 8.1 p -78.79 159.67 4.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.062 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.523 ' N ' HG22 ' A' ' 71' ' ' VAL . 3.6 tmtm? -143.66 160.61 40.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.864 179.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -40.27 -32.96 0.21 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.773 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.7 p-10 -164.93 30.97 0.06 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.922 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 71.7 mt-10 -153.35 158.34 41.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.868 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.9 HD11 ' CD1' ' A' ' 69' ' ' TYR . 6.0 tp -123.14 137.47 54.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.416 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.797 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.0 pp -127.42 134.67 65.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.424 -179.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.773 HD11 HD11 ' A' ' 4' ' ' LEU . 28.2 mt -86.99 124.75 33.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.858 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.519 HD11 ' HB2' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -82.43 -64.74 1.11 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.824 179.96 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.467 ' O ' HD22 ' A' ' 67' ' ' LEU . 0.4 OUTLIER -162.33 171.21 17.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.085 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.699 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.5 tm? -126.26 132.05 51.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.946 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.699 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -143.59 165.46 27.16 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.467 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 17.3 m -104.79 173.95 6.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.724 0.297 . . . . 0.0 110.983 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -64.36 -24.52 67.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.06 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 73.4 m -89.98 -26.83 20.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.08 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -73.91 -68.18 0.54 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.041 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.508 HD12 HD12 ' A' ' 66' ' ' LEU . 17.3 mt -72.15 -32.11 66.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.018 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.899 179.918 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 mp . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.907 0.384 . . . . 0.0 111.007 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.55 172.07 8.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.77 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.9 tt -137.27 153.98 50.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.899 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.76 ' HB2' HG22 ' A' ' 77' ' ' ILE . 2.6 t30 -146.48 176.31 9.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.917 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.3 mt -137.74 131.24 31.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.867 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -103.28 166.06 10.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.915 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.63 -30.88 69.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.886 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.1 m -76.55 -41.73 45.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.863 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.589 ' HE2' HD13 ' A' ' 67' ' ' LEU . 22.5 t80 -71.45 -34.88 70.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.87 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -59.85 -40.71 89.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.802 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.546 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -89.98 -15.31 32.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.276 -179.959 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.457 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 5.0 m-20 -90.36 -11.12 41.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.185 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.697 ' O ' HD13 ' A' ' 18' ' ' LEU . 17.2 t80 -90.74 -67.08 0.87 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.978 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.843 ' HA ' HD22 ' A' ' 18' ' ' LEU . 2.3 m-20 -90.95 -34.37 15.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.163 -179.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.546 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -76.44 -19.42 58.08 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.508 -179.127 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.457 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 36.5 tp -82.47 -34.25 28.15 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.843 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.1 OUTLIER -50.98 -48.69 61.14 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.905 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 27.7 mt -90.16 12.86 16.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.467 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -111.09 31.65 5.89 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.878 0.371 . . . . 0.0 110.86 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.01 22.83 22.0 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.473 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.496 ' CD1' HD12 ' A' ' 18' ' ' LEU . 29.4 t80 -117.08 143.91 45.25 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.81 0.338 . . . . 0.0 110.851 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.567 ' HB3' HG23 ' A' ' 26' ' ' VAL . 3.9 t70 -91.92 111.05 22.43 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.856 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.834 ' HA ' HD23 ' A' ' 27' ' ' LEU . 36.2 p-10 -53.89 -27.31 29.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.202 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.8 t -60.73 -19.39 58.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.246 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.567 HG23 ' HB3' ' A' ' 23' ' ' ASP . 21.8 t -88.55 -40.7 13.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.691 0.281 . . . . 0.0 111.486 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.834 HD23 ' HA ' ' A' ' 24' ' ' ASP . 1.2 pp -57.65 -36.48 71.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.118 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -62.78 -28.01 69.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.009 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -75.06 -34.2 61.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.186 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 1.101 HG23 HG21 ' A' ' 61' ' ' ILE . 10.9 p -89.96 -47.29 14.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.395 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.578 HD12 HG13 ' A' ' 30' ' ' VAL . 1.6 mp -58.05 -25.14 25.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.86 0.362 . . . . 0.0 110.707 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.867 HD23 ' N ' ' A' ' 33' ' ' THR . 0.2 OUTLIER -70.52 -52.5 21.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.27 -179.721 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.867 ' N ' HD23 ' A' ' 32' ' ' LEU . 89.3 m -66.56 -23.97 66.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.918 -179.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.579 HD21 HD21 ' A' ' 40' ' ' LEU . 76.2 mt -89.95 -33.61 16.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.756 0.312 . . . . 0.0 111.591 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.1 mtt180 -98.81 20.22 13.48 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -179.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.51 ' O ' ' HB3' ' A' ' 37' ' ' LYS . 4.0 mtmt -108.69 -55.88 2.34 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.033 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.51 ' HB3' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 150.83 -20.38 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.122 0.569 . . . . 0.0 110.801 179.622 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.62 126.36 89.48 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.605 -0.27 . . . . 0.0 110.987 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -75.08 169.41 22.65 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.449 2.099 . . . . 0.0 112.278 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.579 HD21 HD21 ' A' ' 34' ' ' LEU . 4.6 mt -95.82 126.09 40.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.802 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.407 ' HB2' ' CE1' ' A' ' 44' ' ' PHE . 5.4 m-20 -72.26 162.16 75.21 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.055 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -68.89 -27.54 30.65 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.609 2.206 . . . . 0.0 112.304 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -64.76 -15.54 61.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.326 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.407 ' CE1' ' HB2' ' A' ' 41' ' ' ASP . 24.6 m-85 -79.17 -0.19 30.85 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.57 -0.287 . . . . 0.0 111.552 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 67.83 48.56 1.01 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.959 0.409 . . . . 0.0 110.843 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.2 p-10 -88.92 89.02 7.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.772 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.405 ' HA ' ' NH1' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -151.48 -179.88 7.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.044 -179.796 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -84.46 125.08 32.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.112 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 90.0 mt -72.3 -178.57 2.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.898 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -110.15 172.75 6.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.928 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 78.21 -117.96 4.8 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.587 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.2 mttm -89.63 -18.03 27.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.578 0.228 . . . . 0.0 111.298 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 16.5 m-90 -96.18 38.26 1.2 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.805 0.336 . . . . 0.0 111.083 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.435 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 5.0 mtpt -83.96 -50.92 0.62 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.042 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 17.0 Cg_exo -66.62 -8.84 22.29 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.505 2.137 . . . . 0.0 112.475 179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.599 ' HA ' HD12 ' A' ' 70' ' ' LEU . 13.1 m-85 -105.75 -171.64 1.94 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.904 0.383 . . . . 0.0 111.066 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.405 ' NH1' ' HA ' ' A' ' 47' ' ' HIS . 4.1 ttm-85 -138.92 136.22 35.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.847 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.454 ' OE2' HD22 ' A' ' 87' ' ' LEU . 6.9 tp10 -106.19 162.79 13.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.114 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.559 ' SG ' HD13 ' A' ' 40' ' ' LEU . 3.1 t -162.71 117.45 1.78 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.906 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -90.28 89.47 7.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.932 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 1.101 HG21 HG23 ' A' ' 30' ' ' VAL . 4.0 mp -60.53 -31.4 48.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.069 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.5 mttm -141.42 172.86 5.45 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.765 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -66.78 -6.35 15.42 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.706 2.27 . . . . 0.0 112.663 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -142.27 26.09 1.84 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.879 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.616 ' C ' HD23 ' A' ' 66' ' ' LEU . 64.5 t -141.06 140.85 32.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.184 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.616 HD23 ' C ' ' A' ' 65' ' ' VAL . 0.0 OUTLIER -159.14 110.3 2.06 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.759 179.863 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.589 HD13 ' HE2' ' A' ' 10' ' ' PHE . 0.2 OUTLIER -108.3 131.8 54.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.712 -179.973 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.448 ' O ' HD12 ' A' ' 67' ' ' LEU . 41.5 t -88.68 140.45 15.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.98 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.414 ' CE2' ' HB2' ' A' ' 59' ' ' CYS . 2.6 p90 -146.77 159.36 43.6 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.918 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.778 ' HB2' HD11 ' A' ' 77' ' ' ILE . 2.8 tp -109.24 171.98 7.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.856 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 28.7 t -123.26 103.71 13.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.181 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.06 168.37 10.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.743 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -58.76 104.04 0.2 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.832 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 57.0 22.05 6.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.122 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -148.68 138.21 21.95 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.748 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.7 tp -108.03 143.93 36.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.933 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.778 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.2 pp -131.64 130.26 62.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.201 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.403 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 74.9 mt -76.28 135.4 39.62 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.747 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.36 -62.68 1.29 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.137 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.69 164.59 18.99 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.931 0.396 . . . . 0.0 111.472 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.612 ' C ' HD13 ' A' ' 81' ' ' LEU . 3.1 tm? -125.19 126.73 45.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.598 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.447 ' HA3' HD11 ' A' ' 87' ' ' LEU . . . -146.31 -174.9 18.86 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.557 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 22.7 m -110.55 174.46 5.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.91 0.386 . . . . 0.0 111.031 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.33 -25.3 65.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.981 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 69.6 m -86.93 -15.97 37.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.281 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -86.79 -69.28 0.69 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.02 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.464 ' H ' HD12 ' A' ' 87' ' ' LEU . 6.5 mp -63.15 -41.23 99.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.079 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.208 -0.901 . . . . 0.0 110.958 179.961 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.89 HD13 ' HB2' ' A' ' 76' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.775 0.322 . . . . 0.0 110.917 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.9 151.32 47.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.892 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.2 tt -121.21 154.38 36.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.83 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.715 ' HB2' HG22 ' A' ' 77' ' ' ILE . 0.7 OUTLIER -147.54 155.81 42.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.901 179.978 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.9 mp -124.78 126.78 46.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.976 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -100.52 158.97 15.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.957 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.3 tttm -61.26 -31.74 71.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.899 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 6.6 m -66.1 -28.96 69.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.032 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.692 ' HE1' HD13 ' A' ' 67' ' ' LEU . 55.7 t80 -73.87 -32.4 63.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.134 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -79.29 -30.08 42.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.056 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.03 -16.2 30.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.387 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -81.74 -30.48 32.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.639 0.257 . . . . 0.0 111.148 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.887 ' CE2' HD13 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -90.42 -53.02 4.62 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 179.538 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.604 ' HA ' HD22 ' A' ' 18' ' ' LEU . 11.9 m-20 -51.48 -34.47 35.84 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.06 0.457 . . . . 0.0 110.074 178.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.54 -27.98 37.42 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.097 179.044 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.2 mt -76.12 -41.5 49.92 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.1 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.604 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.0 OUTLIER -54.13 -33.18 57.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.992 179.914 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 mt -90.06 -5.86 56.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.617 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.64 38.01 1.24 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.846 0.355 . . . . 0.0 111.068 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.67 26.71 41.27 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.502 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.516 ' CD1' HD12 ' A' ' 18' ' ' LEU . 10.6 t80 -119.51 128.39 53.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.814 0.34 . . . . 0.0 110.88 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.41 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 8.0 t70 -84.85 131.28 34.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.996 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.7 p-10 -56.9 -21.8 32.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.099 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.6 t -48.15 -53.45 16.69 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.821 0.343 . . . . 0.0 110.955 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.42 ' HB ' ' CZ ' ' A' ' 22' ' ' PHE . 39.2 t -65.14 -35.11 74.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.669 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.887 HD13 ' CE2' ' A' ' 14' ' ' PHE . 1.1 tp -59.14 -33.52 70.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.669 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -59.35 -47.09 86.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.912 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -63.14 -40.06 96.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.932 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 94.6 t -66.27 -72.46 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.09 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.796 HD13 ' CD1' ' A' ' 27' ' ' LEU . 1.2 mp -45.76 -33.45 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 121.152 0.501 . . . . 0.0 110.523 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.839 HD23 ' N ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -55.51 -59.97 4.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.17 179.35 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.839 ' N ' HD23 ' A' ' 32' ' ' LEU . 64.6 m -54.34 -24.45 19.39 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.307 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 31' ' ' ILE . 17.7 mt -73.36 -62.08 1.6 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.844 0.354 . . . . 0.0 110.961 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.4 mtp180 -67.9 -49.0 64.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.029 0.442 . . . . 0.0 110.921 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.617 ' HE2' HD21 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -68.55 -13.77 62.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.533 179.882 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.547 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 1.3 pttm 52.59 70.73 0.54 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.679 -179.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.699 ' HB3' HG23 ' A' ' 33' ' ' THR . 1.3 tm-20 -81.56 142.48 49.84 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.636 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -61.32 104.8 0.31 Allowed 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.366 2.044 . . . . 0.0 112.135 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.445 HD22 ' CD2' ' A' ' 44' ' ' PHE . 57.3 mt -68.3 137.61 54.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.99 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -87.29 158.42 52.19 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.82 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.32 -26.72 63.65 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.504 2.136 . . . . 0.0 112.224 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -67.68 -21.46 65.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.094 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.445 ' CD2' HD22 ' A' ' 40' ' ' LEU . 3.2 m-85 -56.5 -27.64 57.75 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.003 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 63.29 61.33 1.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.939 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.0 p-10 -91.45 77.35 5.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.871 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -125.89 -175.29 3.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.043 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.07 166.97 21.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.253 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.572 ' N ' HD12 ' A' ' 49' ' ' LEU . 1.0 OUTLIER -104.44 -167.55 1.37 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.885 179.883 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -126.1 151.38 47.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.864 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 92.12 -136.03 13.03 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.564 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.22 -11.81 61.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.614 0.245 . . . . 0.0 111.352 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 17.3 m-90 -96.69 39.33 1.17 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.969 0.414 . . . . 0.0 111.007 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.508 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 2.4 ttmm -72.71 -50.25 7.62 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.468 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.508 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 63.1 Cg_endo -74.43 0.43 8.61 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.336 2.024 . . . . 0.0 112.932 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.447 ' CD1' HD13 ' A' ' 70' ' ' LEU . 39.4 m-85 -102.83 179.78 4.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.808 0.337 . . . . 0.0 110.817 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.42 ' NH1' HG21 ' A' ' 71' ' ' VAL . 12.1 ttm180 -147.14 134.39 20.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.833 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.5 ' HG3' HG22 ' A' ' 68' ' ' VAL . 4.0 tt0 -95.85 162.93 13.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.002 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.433 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 21.6 t -163.87 105.91 0.93 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.847 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.434 ' CD2' ' N ' ' A' ' 60' ' ' HIS . 6.8 m170 -84.79 94.96 8.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.955 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.547 HD11 ' HB3' ' A' ' 67' ' ' LEU . 4.4 mp -66.09 -25.22 35.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.913 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.43 169.96 10.67 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.766 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -70.86 1.2 5.4 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.798 2.332 . . . . 0.0 112.866 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -144.38 24.06 1.6 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.845 0.355 . . . . 0.0 110.778 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.813 ' O ' HD23 ' A' ' 66' ' ' LEU . 41.4 t -136.49 153.13 30.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.919 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.813 HD23 ' O ' ' A' ' 65' ' ' VAL . 3.7 mt -145.56 112.27 5.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.775 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.742 HD12 ' N ' ' A' ' 68' ' ' VAL . 4.7 tp -106.66 128.74 54.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.018 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.742 ' N ' HD12 ' A' ' 67' ' ' LEU . 66.9 t -108.4 134.16 51.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.753 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.433 ' CE2' ' HB2' ' A' ' 59' ' ' CYS . 2.8 p90 -144.07 165.43 27.81 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.886 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.466 ' HB2' HD11 ' A' ' 77' ' ' ILE . 8.3 tp -100.24 157.53 16.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.871 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.42 HG21 ' NH1' ' A' ' 57' ' ' ARG . 21.4 t -113.31 103.82 16.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.116 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.9 tttp -83.17 161.74 21.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.719 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -44.02 -35.87 2.27 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.443 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.0 p-10 -156.0 29.66 0.36 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.82 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -152.5 156.6 39.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.814 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.89 ' HB2' HD13 ' A' ' 2' ' ' LEU . 11.8 tp -119.67 139.92 51.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.715 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.715 HG22 ' HB2' ' A' ' 5' ' ' ASN . 1.8 pp -133.35 127.95 54.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.212 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.43 HD22 HD21 ' A' ' 67' ' ' LEU . 58.9 mt -70.22 139.81 52.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.95 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.32 -73.72 0.65 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.058 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.08 174.61 13.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.875 0.369 . . . . 0.0 111.364 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.897 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.1 tm? -120.93 140.65 51.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.838 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.897 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -147.13 -176.85 21.2 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.572 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.1 t -139.81 -172.03 3.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.818 0.342 . . . . 0.0 110.912 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.8 t-160 -72.63 -28.66 62.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.965 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.01 -23.06 21.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.088 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -85.74 -71.12 0.55 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.874 0.368 . . . . 0.0 111.003 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.529 HD12 ' CD1' ' A' ' 66' ' ' LEU . 72.6 mt -60.45 -40.66 91.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.992 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.175 -0.917 . . . . 0.0 110.976 179.946 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.3 mt . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.897 0.38 . . . . 0.0 110.857 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.42 142.37 55.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.781 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.555 HD12 HD23 ' A' ' 76' ' ' LEU . 7.7 tp -114.03 154.45 27.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.013 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.719 ' HB2' HG22 ' A' ' 77' ' ' ILE . 2.0 t30 -138.9 176.04 9.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.832 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.0 mt -138.9 129.06 25.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.997 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 25.8 mmtm -97.21 -177.45 3.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.784 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.83 -33.85 39.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.924 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.6 m -74.59 -34.34 62.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.016 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.473 ' HE1' HD13 ' A' ' 67' ' ' LEU . 36.0 t80 -61.16 -29.22 69.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.075 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -71.55 -42.39 67.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.02 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.549 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 2.6 mtmm -78.54 -19.51 52.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.284 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.406 ' C ' ' HB2' ' A' ' 17' ' ' LEU . 20.7 m-20 -90.4 -10.39 44.05 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.095 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.536 ' O ' HD21 ' A' ' 18' ' ' LEU . 6.7 t80 -91.17 -66.03 0.96 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.801 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -91.46 -37.73 12.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.89 -0.595 . . . . 0.0 112.15 -179.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.549 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -75.49 -18.27 59.89 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 120.941 -0.304 . . . . 0.0 111.677 -178.799 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.43 HD11 ' HG3' ' A' ' 86' ' ' GLU . 1.2 tt -79.81 -34.1 39.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.977 0.418 . . . . 0.0 109.891 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.782 HD13 ' HB3' ' A' ' 24' ' ' ASP . 0.8 OUTLIER -66.65 -33.82 76.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.799 179.641 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.9 mt -80.57 -36.05 33.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.911 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -57.61 -22.73 47.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.086 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.98 36.7 0.27 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.687 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.406 ' CE2' ' O ' ' A' ' 23' ' ' ASP . 75.0 t80 -122.11 163.3 19.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.72 0.295 . . . . 0.0 110.951 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.406 ' O ' ' CE2' ' A' ' 22' ' ' PHE . 9.9 t70 -86.31 123.08 31.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.941 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.782 ' HB3' HD13 ' A' ' 18' ' ' LEU . 9.4 p-10 -77.85 -31.61 51.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.985 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.0 t -60.86 -40.79 94.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.35 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 45.3 t -58.66 -37.99 68.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.341 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.562 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.6 OUTLIER -60.83 -33.58 73.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.975 -179.885 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.412 ' N ' ' HG ' ' A' ' 27' ' ' LEU . 5.6 t30 -58.36 -29.0 65.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.122 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -72.04 -44.39 63.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.031 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.645 HG13 HD12 ' A' ' 31' ' ' ILE . 10.8 p -80.13 -46.15 22.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.148 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.645 HD12 HG13 ' A' ' 30' ' ' VAL . 1.6 mp -58.42 -29.96 39.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.921 0.391 . . . . 0.0 110.657 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.448 ' C ' HD23 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -67.1 -24.7 65.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.166 -179.791 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 51.4 m -90.21 -24.0 21.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.568 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.0 mt -90.11 -38.8 13.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.593 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.566 ' CD ' HG23 ' A' ' 31' ' ' ILE . 51.9 mtp85 -90.56 20.15 4.81 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -179.292 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.479 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 2.2 mttm -110.98 -55.76 2.45 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 121.106 -0.238 . . . . 0.0 111.012 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.479 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 155.65 -20.5 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.109 179.669 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -78.24 113.05 30.31 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.152 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -74.58 -179.55 4.95 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.545 2.163 . . . . 0.0 112.108 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.47 HD13 ' SG ' ' A' ' 59' ' ' CYS . 15.6 mt -87.78 116.1 25.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.822 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -60.9 159.38 27.21 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.999 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.46 -9.34 25.03 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.602 2.201 . . . . 0.0 112.574 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.14 8.95 24.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.293 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -92.39 11.7 25.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.658 0.266 . . . . 0.0 111.294 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 60.93 32.05 19.98 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.803 0.335 . . . . 0.0 110.984 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -69.26 98.61 1.06 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.81 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 32.5 m80 -144.27 177.17 8.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.888 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.53 129.82 34.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.135 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.401 HD11 ' HG3' ' A' ' 58' ' ' GLU . 21.8 mt -72.63 -178.93 2.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.868 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.3 mtmt -120.36 169.72 10.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.924 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 79.12 -118.25 4.74 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.492 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.53 -21.75 30.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.663 0.268 . . . . 0.0 111.221 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 6.2 m95 -96.27 38.71 1.18 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.848 0.356 . . . . 0.0 110.885 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.438 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 11.6 ttmt -73.77 -51.29 5.26 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.237 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.438 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 89.2 Cg_endo -79.77 47.1 2.41 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.307 2.005 . . . . 0.0 112.481 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.419 ' HA ' HD11 ' A' ' 70' ' ' LEU . 96.7 m-85 -157.65 175.92 13.29 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.868 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.568 ' O ' HG13 ' A' ' 68' ' ' VAL . 4.3 ttm180 -130.96 134.39 46.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.853 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.401 ' HG3' HD11 ' A' ' 49' ' ' LEU . 2.6 tm-20 -104.83 167.64 9.59 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.982 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.47 ' SG ' HD13 ' A' ' 40' ' ' LEU . 6.3 t -171.1 115.4 0.42 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.659 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.418 ' O ' ' CG ' ' A' ' 60' ' ' HIS . 12.2 p80 -93.33 109.55 21.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.058 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.49 HD12 ' N ' ' A' ' 61' ' ' ILE . 4.3 mp -77.92 -27.68 15.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.754 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.43 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 12.6 mtpp -133.18 168.94 15.4 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.6 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.43 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 14.8 Cg_exo -68.72 -0.3 5.89 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.634 2.222 . . . . 0.0 113.015 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -144.47 27.61 1.37 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.811 0.338 . . . . 0.0 110.801 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.809 ' O ' HD23 ' A' ' 66' ' ' LEU . 48.3 t -136.38 148.72 27.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.037 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.809 HD23 ' O ' ' A' ' 65' ' ' VAL . 2.0 mt -147.06 93.24 2.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.78 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.622 HD12 ' N ' ' A' ' 68' ' ' VAL . 3.2 tp -93.81 120.45 34.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.85 -179.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.622 ' N ' HD12 ' A' ' 67' ' ' LEU . 47.7 t -94.32 135.35 28.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.04 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.879 ' CD1' HD11 ' A' ' 76' ' ' LEU . 29.6 p90 -147.36 168.2 22.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.101 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.741 ' HB2' HD11 ' A' ' 77' ' ' ILE . 1.6 tp -122.18 143.36 49.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.694 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -102.07 99.15 7.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.246 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.416 ' O ' ' C ' ' A' ' 73' ' ' ASP . 0.0 OUTLIER -77.44 167.09 22.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.72 179.883 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.416 ' C ' ' O ' ' A' ' 72' ' ' LYS . 1.2 p30 -30.04 -60.75 0.17 Allowed 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.196 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -143.67 30.82 1.33 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.789 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -154.51 109.44 3.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.194 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.879 HD11 ' CD1' ' A' ' 69' ' ' TYR . 1.6 tp -70.32 141.82 52.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.79 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.741 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.1 pp -129.8 136.54 58.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.321 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.465 HD11 HD21 ' A' ' 4' ' ' LEU . 82.0 mt -79.41 137.88 37.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.835 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.438 HD12 ' HD2' ' A' ' 80' ' ' ARG . 0.2 OUTLIER -96.92 -72.8 0.63 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.959 179.968 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.438 ' HD2' HD12 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -158.16 174.01 15.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.191 179.953 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.607 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.3 tm? -120.04 131.76 55.23 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.746 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.607 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -145.4 -174.82 17.97 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.545 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 20.0 m -152.55 -173.31 4.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.905 0.383 . . . . 0.0 110.805 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 -65.72 -30.57 71.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.854 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 55.9 m -89.91 -30.27 17.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.94 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.43 ' HG3' HD11 ' A' ' 17' ' ' LEU . 1.9 mm-40 -74.77 -73.39 0.24 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.943 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.426 HD12 HD12 ' A' ' 66' ' ' LEU . 33.9 mt -65.64 -34.19 77.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.842 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.946 179.983 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 20.0 mt . . . . . 0 N--CA 1.457 -0.104 0 CA-C-O 120.829 0.347 . . . . 0.0 110.935 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.45 151.48 20.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.815 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.1 tp -116.49 148.75 40.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.852 0.358 . . . . 0.0 111.051 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.496 ' HB2' HG22 ' A' ' 77' ' ' ILE . 5.9 t30 -140.67 -179.13 5.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.823 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.429 HD21 ' NH2' ' A' ' 35' ' ' ARG . 3.1 mp -144.62 143.69 30.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.929 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.6 mmtt -114.88 -177.92 3.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.906 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.46 -31.46 67.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.812 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.84 -33.59 68.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.928 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.484 ' CZ ' HD13 ' A' ' 78' ' ' LEU . 41.1 t80 -80.06 -32.13 39.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.938 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -59.94 -38.56 82.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.906 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.558 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 2.7 pttp -86.27 -22.68 26.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.165 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -90.7 -10.43 43.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.241 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.701 ' O ' HD13 ' A' ' 18' ' ' LEU . 93.9 t80 -90.58 -67.46 0.85 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.16 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.827 ' HA ' HD22 ' A' ' 18' ' ' LEU . 0.5 OUTLIER -91.0 -31.46 16.31 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -179.21 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.558 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -77.91 -26.52 49.1 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.482 -179.07 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.54 -31.34 60.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.92 0.39 . . . . 0.0 110.17 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.827 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.2 OUTLIER -55.68 -43.3 76.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.045 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.455 ' O ' HD12 ' A' ' 19' ' ' LEU . 4.0 pp -90.11 15.02 10.95 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.494 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -113.64 33.1 5.36 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.795 0.331 . . . . 0.0 110.813 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.55 27.08 23.38 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.304 -179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.455 ' CD1' ' N ' ' A' ' 23' ' ' ASP . 14.3 t80 -115.2 149.7 37.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.83 0.348 . . . . 0.0 110.824 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.455 ' N ' ' CD1' ' A' ' 22' ' ' PHE . 46.2 t0 -92.52 98.75 11.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.91 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -54.06 -30.21 47.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.244 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.4 m -58.88 -26.22 64.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.161 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.47 ' O ' HG23 ' A' ' 30' ' ' VAL . 38.3 t -84.6 -36.47 11.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.299 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.579 ' CD2' HD21 ' A' ' 18' ' ' LEU . 0.2 OUTLIER -55.53 -35.8 66.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.85 -179.925 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.448 ' O ' ' HB3' ' A' ' 32' ' ' LEU . 8.7 t-20 -53.41 -66.09 0.45 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.172 -179.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -46.9 -28.57 1.64 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.484 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 26' ' ' VAL . 37.9 t -75.37 -69.59 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.306 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.1 mp -55.97 -24.38 17.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.082 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.487 ' C ' HD23 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -71.23 -21.17 62.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.97 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.6 m -90.0 -33.55 16.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.881 0.372 . . . . 0.0 111.464 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.774 HD21 HD21 ' A' ' 40' ' ' LEU . 14.1 mt -90.17 -26.33 20.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.786 -179.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.429 ' NH2' HD21 ' A' ' 6' ' ' LEU . 26.6 mtt180 -99.01 20.29 13.57 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -179.138 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.459 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 2.7 mtmt -116.47 -55.63 2.36 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.92 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.459 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 157.45 -20.55 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.161 179.665 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -63.84 110.64 4.01 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.069 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.43 166.89 25.65 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.399 2.066 . . . . 0.0 112.235 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.774 HD21 HD21 ' A' ' 34' ' ' LEU . 8.5 mt -94.71 123.25 38.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.977 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -68.2 156.86 89.06 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.934 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.33 -8.8 24.48 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.678 2.252 . . . . 0.0 112.512 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -89.48 12.01 17.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.395 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -98.89 14.23 29.74 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.711 0.291 . . . . 0.0 111.249 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 56.02 36.08 26.72 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.856 0.36 . . . . 0.0 111.064 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -82.56 90.45 6.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.902 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -138.62 -178.38 5.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.873 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.36 142.03 32.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.213 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.655 HD12 ' HB3' ' A' ' 53' ' ' TRP . 15.3 mt -83.62 -172.25 4.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.798 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.8 mmtt -116.57 163.12 16.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.975 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.82 -136.07 18.2 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.52 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.5 mmpt? -67.22 -18.24 65.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.566 0.222 . . . . 0.0 111.225 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.655 ' HB3' HD12 ' A' ' 49' ' ' LEU . 5.3 m-90 -96.45 31.93 2.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.741 0.305 . . . . 0.0 111.154 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 3.0 mttt -79.63 -51.38 1.19 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.911 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 23.7 Cg_exo -63.76 -11.81 28.46 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.514 2.143 . . . . 0.0 112.234 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.686 ' HD1' HD13 ' A' ' 70' ' ' LEU . 73.1 m-85 -105.17 171.87 7.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.813 0.339 . . . . 0.0 110.973 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.0 ttp85 -125.73 154.35 42.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.837 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.514 ' HB2' HD21 ' A' ' 49' ' ' LEU . 0.2 OUTLIER -117.79 162.22 18.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.054 -179.969 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.633 ' SG ' HD13 ' A' ' 40' ' ' LEU . 38.0 t -150.65 145.33 25.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.803 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.448 ' CE1' HD22 ' A' ' 66' ' ' LEU . 9.9 m170 -116.49 87.19 2.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.944 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.616 ' H ' HD12 ' A' ' 61' ' ' ILE . 5.3 mp -60.01 -28.28 40.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.936 0.398 . . . . 0.0 110.645 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.454 ' HB2' ' CD ' ' A' ' 63' ' ' PRO . 1.3 ptmm? -160.38 169.65 9.82 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.331 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.454 ' CD ' ' HB2' ' A' ' 62' ' ' LYS . 16.7 Cg_exo -67.93 5.8 0.99 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.697 2.264 . . . . 0.0 113.662 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -139.86 26.14 2.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.55 0.214 . . . . 0.0 111.326 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.815 ' O ' HD23 ' A' ' 66' ' ' LEU . 47.2 t -155.6 149.32 11.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.931 0.396 . . . . 0.0 111.506 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.815 HD23 ' O ' ' A' ' 65' ' ' VAL . 4.2 mt -146.82 117.33 7.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.663 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.675 HD22 ' N ' ' A' ' 68' ' ' VAL . 1.5 tm? -107.22 131.79 53.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.906 0.384 . . . . 0.0 111.189 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.675 ' N ' HD22 ' A' ' 67' ' ' LEU . 71.3 t -105.62 118.6 53.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.811 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.488 ' CD2' HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -133.64 -179.24 5.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.473 -179.296 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.686 HD13 ' HD1' ' A' ' 56' ' ' PHE . 7.2 tp -125.72 169.36 12.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.826 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.6 t -121.02 100.48 9.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.255 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.542 ' HD2' HG23 ' A' ' 77' ' ' ILE . 0.0 OUTLIER -75.85 163.63 27.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.549 179.926 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -43.18 -36.91 1.89 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.416 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -154.13 25.68 0.48 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.836 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 75.1 mt-10 -149.41 173.39 13.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.876 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.488 HD21 ' CD2' ' A' ' 69' ' ' TYR . 0.4 OUTLIER -128.53 144.61 51.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.5 179.593 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.55 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.0 pp -132.31 132.02 60.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.431 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.484 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 73.6 mt -80.62 125.92 30.61 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.643 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.558 HD11 ' CE1' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -87.74 -63.85 1.24 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.093 -179.759 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.526 ' O ' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -159.67 169.42 23.77 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.031 0.444 . . . . 0.0 111.381 179.775 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.889 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.2 tm? -119.79 141.06 49.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.75 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.889 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -157.03 -165.71 15.41 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.597 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 49.2 m -149.89 -175.48 5.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.787 0.327 . . . . 0.0 110.903 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 62.0 t-80 -68.51 -29.44 68.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.077 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.3 m -90.01 -23.67 21.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.187 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.11 -74.35 0.38 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.934 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 16.0 mt -68.39 -41.33 80.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.936 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.926 -179.958 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.8 mt . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.87 0.367 . . . . 0.0 110.857 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.18 148.23 36.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.828 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.648 HD11 HD11 ' A' ' 78' ' ' LEU . 9.1 tt -121.56 154.88 36.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.981 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.731 ' HB2' HG22 ' A' ' 77' ' ' ILE . 5.4 t30 -140.4 171.23 14.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.79 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.9 mp -139.68 129.3 24.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.991 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.4 169.46 8.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.847 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -29.92 67.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.002 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.2 m -77.11 -56.52 4.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.008 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.437 ' CZ ' HD13 ' A' ' 78' ' ' LEU . 62.7 t80 -58.16 -33.58 69.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.048 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -61.26 -42.85 99.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.086 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.578 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 14.0 mttm -90.13 -16.59 29.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.565 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.405 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 1.8 m-20 -90.78 -11.17 40.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.496 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.652 ' O ' HD13 ' A' ' 18' ' ' LEU . 25.4 t80 -90.84 -67.56 0.84 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.206 -179.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.789 ' HA ' HD22 ' A' ' 18' ' ' LEU . 28.4 t0 -90.84 -33.13 15.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.312 -0.404 . . . . 0.0 112.082 -179.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.578 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 2.9 mttt -74.53 -28.04 60.8 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.948 -179.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.405 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 30.6 tp -70.92 -35.77 72.39 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.789 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.1 OUTLIER -57.99 -33.17 68.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.66 179.812 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 mt -90.05 -6.86 55.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.435 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -96.07 27.15 3.77 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.713 0.292 . . . . 0.0 111.215 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.71 23.03 19.5 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.73 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.46 ' CD1' HD12 ' A' ' 18' ' ' LEU . 11.8 t80 -116.61 122.99 46.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.871 0.367 . . . . 0.0 110.774 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.424 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 14.6 t0 -66.65 128.84 37.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.898 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.862 ' HA ' HD23 ' A' ' 27' ' ' LEU . 7.8 p-10 -78.1 -3.2 41.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.517 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.2 t -82.15 -27.32 32.8 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.685 0.279 . . . . 0.0 111.106 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.3 t -80.57 -36.65 16.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.439 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.862 HD23 ' HA ' ' A' ' 24' ' ' ASP . 2.0 pp -57.1 -37.37 71.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.056 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -57.76 -24.09 55.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.204 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -78.61 -35.37 45.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.112 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.742 HG21 HG11 ' A' ' 65' ' ' VAL . 11.5 p -90.1 -43.49 14.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.226 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.583 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -58.39 -33.04 46.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.772 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.738 HD23 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -60.06 -56.64 19.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.641 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.738 ' N ' HD23 ' A' ' 32' ' ' LEU . 85.0 m -55.59 -24.05 30.69 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.378 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.547 HD12 ' HA ' ' A' ' 31' ' ' ILE . 16.1 mt -86.61 -34.4 19.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.759 0.314 . . . . 0.0 111.214 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -103.75 20.15 18.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.436 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.444 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 0.7 OUTLIER -116.14 21.12 13.93 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 -179.708 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.405 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 4.4 ptmm? 44.01 31.23 0.49 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.481 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -93.86 135.44 24.88 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.897 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -74.84 138.07 22.96 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.499 2.133 . . . . 0.0 112.284 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 33.4 mt -90.2 125.44 35.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.797 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -69.22 155.25 93.93 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.839 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -68.68 -10.24 28.5 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.557 2.171 . . . . 0.0 112.532 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.3 pp0? -86.3 7.5 25.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.438 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -92.98 13.91 19.26 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.599 0.238 . . . . 0.0 111.229 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 58.04 41.23 24.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.88 0.371 . . . . 0.0 111.041 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -86.93 111.79 21.16 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.98 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 11.7 m80 -164.72 -178.35 5.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.907 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -87.18 156.47 19.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.083 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.482 HD11 ' CD ' ' A' ' 58' ' ' GLU . 78.0 mt -109.02 176.92 4.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.934 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -124.8 152.65 43.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.876 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 60.91 111.11 0.01 OUTLIER Glycine 0 CA--C 1.508 -0.37 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.531 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 70.38 -44.27 0.57 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.748 0.309 . . . . 0.0 110.878 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 3.4 m0 -104.55 36.24 2.48 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.9 0.381 . . . . 0.0 110.915 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.445 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.1 OUTLIER -74.54 -49.95 4.76 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.159 -179.949 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.445 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 96.0 Cg_endo -84.7 28.99 0.55 Allowed 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.704 2.27 . . . . 0.0 113.018 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.402 ' CD1' ' O ' ' A' ' 55' ' ' PRO . 24.2 m-85 -139.8 170.42 15.92 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.742 0.306 . . . . 0.0 110.832 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.441 ' O ' HG13 ' A' ' 68' ' ' VAL . 24.6 ttm180 -128.73 139.24 52.31 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.996 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.482 ' CD ' HD11 ' A' ' 49' ' ' LEU . 0.8 OUTLIER -97.61 173.19 7.26 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.804 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -169.55 109.95 0.44 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.834 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.416 ' CD2' HD22 ' A' ' 66' ' ' LEU . 9.0 m170 -87.15 78.42 8.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.853 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.671 HD11 ' HB3' ' A' ' 67' ' ' LEU . 3.4 mp -58.26 -50.97 76.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.034 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.504 ' HD3' HG22 ' A' ' 61' ' ' ILE . 2.3 mmmt -115.98 171.73 4.4 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.729 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.428 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 14.3 Cg_exo -68.81 -2.19 9.02 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.681 2.254 . . . . 0.0 112.947 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -145.85 29.49 1.1 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.823 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.804 ' O ' HD23 ' A' ' 66' ' ' LEU . 47.9 t -139.47 147.39 24.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.217 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.804 HD23 ' O ' ' A' ' 65' ' ' VAL . 2.0 mt -147.35 92.15 2.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.777 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.671 ' HB3' HD11 ' A' ' 61' ' ' ILE . 3.3 tm? -85.15 131.78 34.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.979 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.643 ' N ' HD13 ' A' ' 67' ' ' LEU . 96.9 t -109.84 116.05 51.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.042 179.046 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.599 ' CE2' HD11 ' A' ' 76' ' ' LEU . 21.7 p90 -134.33 156.35 48.62 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.233 -179.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.782 ' HB2' HD11 ' A' ' 77' ' ' ILE . 4.3 tp -111.74 -179.79 3.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.891 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.0 t -130.34 108.12 15.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.095 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.68 173.89 6.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.869 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -59.59 102.78 0.16 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.888 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 55.78 25.53 8.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.101 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 84.8 mt-10 -153.43 130.34 10.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.855 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.599 HD11 ' CE2' ' A' ' 69' ' ' TYR . 0.5 OUTLIER -97.31 142.64 28.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.77 179.862 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.782 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.2 pp -129.26 136.29 59.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.305 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.648 HD11 HD11 ' A' ' 4' ' ' LEU . 70.6 mt -87.73 132.23 34.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.645 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.74 -61.29 1.75 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.093 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.409 ' NH2' HG21 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -172.99 162.89 4.72 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.921 0.391 . . . . 0.0 111.358 -179.982 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.569 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.5 tm? -115.36 131.25 56.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.845 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.569 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -139.15 -162.08 8.98 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.498 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 95.7 p -147.8 169.62 19.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.865 0.364 . . . . 0.0 110.819 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -59.42 -28.95 67.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.962 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 18.4 m -90.11 -20.97 22.51 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.183 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -88.52 -75.0 0.44 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.09 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.703 HD12 ' HB2' ' A' ' 66' ' ' LEU . 46.2 mt -56.97 -41.99 79.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.227 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.255 -0.879 . . . . 0.0 111.025 179.998 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 11.6 mt . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.796 0.331 . . . . 0.0 110.838 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.82 138.29 58.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.829 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.416 HD23 ' N ' ' A' ' 5' ' ' ASN . 8.5 tt -116.0 154.68 29.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.927 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.709 ' HB2' HG22 ' A' ' 77' ' ' ILE . 6.6 t30 -135.8 172.41 13.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.827 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.4 mp -139.7 123.13 17.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.918 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -98.55 160.25 14.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.8 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.8 tttp -59.72 -34.87 73.47 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.884 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.38 -25.08 63.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.026 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.404 ' HA ' ' OD2' ' A' ' 13' ' ' ASP . 36.1 t80 -85.34 -33.9 21.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.979 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -58.73 -31.63 68.48 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.086 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.458 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 11.0 mtpp -90.34 -5.23 56.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.857 -179.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.457 ' HB2' ' HB3' ' A' ' 81' ' ' LEU . 17.1 p30 -90.69 -17.46 26.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.808 0.337 . . . . 0.0 111.466 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.802 ' CE2' HD13 ' A' ' 27' ' ' LEU . 30.2 t80 -91.18 -66.77 0.9 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.309 -179.537 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -91.3 -43.02 10.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.032 -179.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.458 ' HB3' ' O ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -71.24 -16.73 62.51 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.675 0.25 . . . . 0.0 111.675 -178.949 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.442 ' HB2' ' C ' ' A' ' 13' ' ' ASP . 1.5 tt -80.29 -36.89 33.75 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.014 0.435 . . . . 0.0 110.014 179.3 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.717 HD13 ' HB3' ' A' ' 24' ' ' ASP . 0.4 OUTLIER -66.8 -42.65 85.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.785 179.707 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.9 mt -60.55 -41.0 93.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.888 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.82 -27.53 63.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.911 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.96 39.89 0.21 Allowed Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.537 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.426 ' CG ' HD22 ' A' ' 17' ' ' LEU . 76.4 t80 -119.75 154.09 34.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.815 0.34 . . . . 0.0 110.823 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.43 ' O ' HG12 ' A' ' 26' ' ' VAL . 5.6 t0 -68.29 132.27 46.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.922 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.717 ' HB3' HD13 ' A' ' 18' ' ' LEU . 5.5 p-10 -90.64 -26.28 19.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.024 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.8 m -68.52 -32.13 71.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.319 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.43 HG12 ' O ' ' A' ' 23' ' ' ASP . 14.1 p -67.85 -30.92 50.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.412 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.802 HD13 ' CE2' ' A' ' 14' ' ' PHE . 1.0 OUTLIER -63.88 -36.66 84.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.021 -179.839 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -64.38 -18.82 65.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.221 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -86.95 -36.71 18.16 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.094 -179.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.766 HG13 HD12 ' A' ' 31' ' ' ILE . 13.3 p -86.05 -47.8 16.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.369 -179.768 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.766 HD12 HG13 ' A' ' 30' ' ' VAL . 1.7 mp -59.58 -40.12 81.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.958 0.408 . . . . 0.0 110.105 179.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.833 HD23 ' N ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -52.21 -62.9 1.34 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.804 179.78 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.833 ' N ' HD23 ' A' ' 32' ' ' LEU . 99.3 m -51.59 -41.0 60.87 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.788 0.328 . . . . 0.0 111.139 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 78.9 mt -59.2 -36.22 74.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.71 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.414 ' HB3' ' NH1' ' A' ' 35' ' ' ARG . 3.0 mtm105 -104.18 19.99 19.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.239 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.452 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 1.4 mmpt? -108.58 15.5 23.72 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.547 0.213 . . . . 0.0 111.496 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.6 mtmt 59.43 21.52 9.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.68 0.276 . . . . 0.0 110.604 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -89.36 110.76 41.14 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.15 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.62 115.03 4.18 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.445 2.097 . . . . 0.0 112.276 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.501 HD13 ' SG ' ' A' ' 59' ' ' CYS . 3.4 mt -61.39 140.62 58.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.89 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -74.09 154.59 88.56 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.894 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.21 -12.49 35.78 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.618 2.212 . . . . 0.0 112.499 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -87.22 8.89 22.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.409 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -90.49 10.07 26.77 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.695 -0.229 . . . . 0.0 111.218 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 64.19 41.7 5.98 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.912 0.387 . . . . 0.0 110.971 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -87.88 79.71 8.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.903 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -139.66 -179.81 6.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.838 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -81.17 123.58 28.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.185 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.438 HD11 ' CG ' ' A' ' 58' ' ' GLU . 10.2 mt -72.21 -177.52 2.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.846 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.2 mttt -125.25 171.14 10.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.802 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.03 -131.27 11.64 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.467 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 19.8 mttt -63.74 -31.45 72.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.719 0.295 . . . . 0.0 110.868 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -97.5 38.97 1.22 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.96 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.439 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 19.4 mttt -73.28 -50.31 6.45 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.09 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.439 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 4.7 Cg_exo -79.81 44.84 1.8 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.883 2.389 . . . . 0.0 112.464 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.404 ' CG ' ' O ' ' A' ' 55' ' ' PRO . 82.6 m-85 -156.7 178.29 10.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.831 0.348 . . . . 0.0 110.953 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.521 ' O ' HG13 ' A' ' 68' ' ' VAL . 0.1 OUTLIER -132.85 131.37 40.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.841 179.968 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.438 ' CG ' HD11 ' A' ' 49' ' ' LEU . 1.8 tt0 -95.99 171.33 8.69 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.938 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.501 ' SG ' HD13 ' A' ' 40' ' ' LEU . 11.5 t -171.02 118.8 0.49 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.817 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.437 ' CD2' ' N ' ' A' ' 60' ' ' HIS . 4.2 m-70 -93.3 99.98 12.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.937 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.589 ' H ' HD12 ' A' ' 61' ' ' ILE . 4.8 mp -70.42 -53.65 21.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.904 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.445 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 0.1 OUTLIER -112.64 172.25 3.68 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.49 179.757 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.445 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 18.1 Cg_exo -65.99 -4.6 10.48 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.51 2.14 . . . . 0.0 112.931 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -143.59 28.46 1.46 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.029 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.736 HG11 HG21 ' A' ' 30' ' ' VAL . 58.4 t -140.46 143.46 29.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.334 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.758 HD12 HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -159.12 111.05 2.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.792 179.742 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.59 HD12 ' O ' ' A' ' 68' ' ' VAL . 0.1 OUTLIER -113.48 134.45 54.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.865 -179.885 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.59 ' O ' HD12 ' A' ' 67' ' ' LEU . 21.7 t -91.88 145.91 6.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.92 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 51.7 p90 -156.17 160.13 39.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.987 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.694 ' HB2' HD11 ' A' ' 77' ' ' ILE . 2.6 tp -109.32 161.24 15.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.824 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.9 t -120.92 100.62 9.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.084 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.56 166.32 23.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.817 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -40.45 -32.25 0.19 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.596 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -167.35 37.7 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.829 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -160.51 102.84 1.38 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.106 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.439 ' C ' HD23 ' A' ' 76' ' ' LEU . 10.5 tt -67.92 134.96 51.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.66 179.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.709 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.2 pp -126.37 128.65 71.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.333 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 82.5 mt -74.27 149.2 40.86 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.546 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -109.81 -71.03 0.78 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.261 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.59 159.21 36.84 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.163 0.506 . . . . 0.0 111.106 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.802 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.9 tm? -113.79 136.78 52.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.535 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.802 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -157.46 173.33 34.91 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.654 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.5 m -108.73 170.27 8.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.839 0.352 . . . . 0.0 110.868 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -59.09 -26.72 64.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.059 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.7 t -83.79 -27.51 28.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.136 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -81.29 -69.74 0.59 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.022 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.758 HD12 HD12 ' A' ' 66' ' ' LEU . 35.1 mt -67.6 -37.87 83.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.002 -179.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.207 -0.901 . . . . 0.0 110.892 -179.982 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.685 HD12 ' HB2' ' A' ' 76' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.816 0.341 . . . . 0.0 110.922 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.52 146.62 39.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.979 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.418 HD11 HD11 ' A' ' 78' ' ' LEU . 7.3 tt -122.01 152.33 39.87 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.861 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.743 ' HB2' HG22 ' A' ' 77' ' ' ILE . 1.8 t30 -138.88 171.36 14.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.937 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.0 mp -147.12 116.69 7.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.919 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -79.82 171.14 15.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.851 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.3 ttpt -60.71 -31.24 70.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.942 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.1 m -72.99 -50.22 24.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.884 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -59.96 -35.7 75.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.812 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -63.41 -37.28 86.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.955 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.561 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 4.7 mmtt -89.16 -22.86 22.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.084 0.468 . . . . 0.0 111.097 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.442 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 4.9 m-20 -90.95 -11.11 40.01 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.232 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.637 ' O ' HD13 ' A' ' 18' ' ' LEU . 29.3 t80 -90.86 -67.38 0.85 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.833 0.349 . . . . 0.0 111.367 -179.558 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.821 ' HA ' HD22 ' A' ' 18' ' ' LEU . 49.6 m-20 -91.09 -33.26 15.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.193 -179.18 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.561 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 12.6 mmtt -76.69 -26.79 55.13 Favored 'General case' 0 C--N 1.334 -0.096 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.161 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.442 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 29.2 tp -71.8 -33.01 68.19 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.185 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.821 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.1 OUTLIER -57.16 -33.58 67.56 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.821 179.967 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.7 mt -89.91 -3.32 58.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.454 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -97.7 26.81 4.77 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.669 0.271 . . . . 0.0 110.995 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 93.26 23.07 25.5 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.786 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.498 ' CD1' HD12 ' A' ' 18' ' ' LEU . 13.0 t80 -110.26 144.19 39.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.834 0.349 . . . . 0.0 110.797 179.768 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.419 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 5.1 t0 -99.61 113.4 25.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.004 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -58.1 -21.03 44.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.424 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.4 m -50.28 -54.43 21.34 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.775 0.322 . . . . 0.0 111.206 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.4 t -68.6 -34.62 66.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.984 0.421 . . . . 0.0 111.156 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.566 HD22 HD11 ' A' ' 18' ' ' LEU . 6.8 tp -65.56 -33.57 76.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.702 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -56.54 -57.92 10.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.128 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.558 ' HA ' HD22 ' A' ' 32' ' ' LEU . 4.6 mt-10 -50.5 -25.78 4.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.466 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.658 HG13 HG21 ' A' ' 61' ' ' ILE . 58.0 t -80.98 -68.25 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.911 0.386 . . . . 0.0 111.573 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.532 HD13 ' CD1' ' A' ' 27' ' ' LEU . 1.1 mp -51.38 -46.33 34.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.842 -179.286 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.832 HD23 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -55.96 -24.6 39.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.645 0.26 . . . . 0.0 111.314 -179.579 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.832 ' N ' HD23 ' A' ' 32' ' ' LEU . 27.4 m -82.11 -30.43 31.17 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.053 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.78 HD21 HD21 ' A' ' 40' ' ' LEU . 3.0 mt -90.13 -28.57 18.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.459 -179.634 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.401 ' HB3' ' NH1' ' A' ' 35' ' ' ARG . 14.0 mtm105 -94.16 20.11 8.43 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.692 -179.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.466 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 4.2 mttt -118.19 -55.72 2.22 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.142 -0.223 . . . . 0.0 110.946 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.466 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 7.3 pttt 156.12 -20.53 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.965 179.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -59.44 111.47 3.84 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.955 -179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 158.73 56.03 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.368 2.046 . . . . 0.0 112.164 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.78 HD21 HD21 ' A' ' 34' ' ' LEU . 13.0 mt -82.64 116.03 21.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.905 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.405 ' HB2' ' CE2' ' A' ' 44' ' ' PHE . 83.3 m-20 -62.66 158.4 51.26 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.956 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.47 -11.33 30.97 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.626 2.217 . . . . 0.0 112.505 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -93.08 17.21 11.23 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.203 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.405 ' CE2' ' HB2' ' A' ' 41' ' ' ASP . 19.6 m-85 -98.04 6.67 47.36 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.261 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 44.5 mm-40 64.8 41.61 4.95 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.848 0.356 . . . . 0.0 110.889 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -86.62 90.4 8.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.933 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 70.2 m-70 -136.67 173.16 12.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.982 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.07 158.01 32.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.156 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.74 HD21 ' CD ' ' A' ' 58' ' ' GLU . 1.8 mp -112.07 -175.43 2.69 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.832 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.3 mttm -124.04 167.68 13.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.909 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 77.29 -133.27 13.02 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.497 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 10.8 mptt -60.45 -31.66 70.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.78 0.324 . . . . 0.0 110.854 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 17.1 m95 -98.63 38.69 1.33 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.973 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.5 -53.73 16.24 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.953 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.415 ' HG2' ' CE1' ' A' ' 56' ' ' PHE . 93.8 Cg_endo -84.94 34.62 0.51 Allowed 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.644 2.229 . . . . 0.0 112.609 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.463 ' HE2' HD21 ' A' ' 79' ' ' LEU . 81.3 m-85 -132.25 -175.45 3.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.878 0.371 . . . . 0.0 110.879 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.11 137.59 36.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.857 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.74 ' CD ' HD21 ' A' ' 49' ' ' LEU . 2.1 tt0 -98.66 171.33 8.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.819 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.476 ' SG ' HD13 ' A' ' 40' ' ' LEU . 9.7 t -167.08 111.88 0.74 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.875 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.63 ' CE1' HD22 ' A' ' 66' ' ' LEU . 10.6 m170 -90.5 82.78 5.84 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.898 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.658 HG21 HG13 ' A' ' 30' ' ' VAL . 3.5 mp -56.13 -31.72 32.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.85 0.357 . . . . 0.0 110.93 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.529 ' HB2' HG23 ' A' ' 65' ' ' VAL . 0.0 OUTLIER -130.59 170.38 11.28 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.653 179.932 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.42 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 11.5 Cg_exo -70.75 0.96 5.59 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.852 2.368 . . . . 0.0 112.952 -179.667 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -147.27 27.46 1.03 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.788 0.328 . . . . 0.0 110.831 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.832 ' O ' HD23 ' A' ' 66' ' ' LEU . 40.6 t -135.26 152.58 32.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.08 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.832 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.8 OUTLIER -146.98 104.2 3.67 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.693 179.771 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.632 ' HB3' HD11 ' A' ' 61' ' ' ILE . 4.2 tp -104.95 121.75 44.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.034 -179.66 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.626 ' N ' HD12 ' A' ' 67' ' ' LEU . 46.3 t -99.08 135.93 32.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.794 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.458 ' CD1' HD11 ' A' ' 76' ' ' LEU . 46.4 p90 -153.3 161.97 41.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.051 -179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.743 ' O ' HD12 ' A' ' 76' ' ' LEU . 5.4 tp -109.96 169.06 8.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.777 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.1 t -127.34 106.66 15.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.133 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.43 163.34 21.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.675 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -43.62 -40.82 4.29 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.467 -179.759 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -150.04 29.25 0.73 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.897 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -151.26 151.67 32.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.828 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.743 HD12 ' O ' ' A' ' 70' ' ' LEU . 37.5 tp -115.09 137.14 52.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.691 179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.743 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.0 pp -130.76 131.3 64.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.275 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.418 HD11 HD11 ' A' ' 4' ' ' LEU . 41.2 mt -82.66 136.9 34.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.788 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.463 HD21 ' HE2' ' A' ' 56' ' ' PHE . 0.3 OUTLIER -92.29 -71.29 0.65 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.982 -179.782 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.417 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -157.42 165.6 35.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.138 -179.957 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.578 ' C ' HD13 ' A' ' 81' ' ' LEU . 3.4 tm? -122.4 123.51 41.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.806 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -138.24 -169.59 11.63 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.416 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -140.29 -178.25 5.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.79 0.328 . . . . 0.0 110.865 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 5.6 t-80 -67.99 -28.71 67.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.032 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 17.9 m -89.95 -26.9 20.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.067 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.81 -68.6 0.68 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.048 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.658 HD12 ' HB2' ' A' ' 66' ' ' LEU . 16.6 mt -71.75 -38.6 70.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.068 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.903 -179.982 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.1 mt . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.869 0.366 . . . . 0.0 110.88 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.4 ' HB2' ' HG3' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -59.02 150.44 24.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.859 179.946 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.628 HD11 HD11 ' A' ' 78' ' ' LEU . 8.6 tt -116.09 144.84 43.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.086 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.84 ' HB2' HG22 ' A' ' 77' ' ' ILE . 2.0 t-20 -133.67 -173.03 3.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.804 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.9 mp -143.91 140.77 29.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.96 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.8 165.58 11.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.819 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.84 -31.33 70.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.795 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.0 t -74.62 -47.8 30.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.941 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.43 ' CE2' HD13 ' A' ' 78' ' ' LEU . 30.5 t80 -59.53 -38.04 79.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.934 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -60.71 -35.11 75.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.931 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.569 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 7.3 mtmp? -85.94 -20.0 29.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.147 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -90.59 -11.51 39.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.282 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.683 ' O ' HD13 ' A' ' 18' ' ' LEU . 46.0 t80 -90.57 -66.97 0.88 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.225 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.82 ' HA ' HD22 ' A' ' 18' ' ' LEU . 7.8 m-20 -90.96 -32.17 16.06 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.084 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.569 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -77.34 -27.29 52.67 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.263 -179.106 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.453 ' O ' ' HB3' ' A' ' 22' ' ' PHE . 1.1 tt -73.42 -33.62 65.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.936 0.398 . . . . 0.0 109.974 179.447 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.82 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.2 OUTLIER -54.91 -42.58 72.36 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.111 -179.983 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 85.8 mt -82.88 -3.26 56.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.543 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.96 37.44 1.31 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.853 0.359 . . . . 0.0 110.983 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 82.86 25.65 48.67 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.387 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.471 ' CD1' HD12 ' A' ' 18' ' ' LEU . 8.9 t80 -116.35 132.18 56.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.755 0.312 . . . . 0.0 110.782 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.403 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 13.5 t0 -87.34 124.11 33.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.907 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.841 ' HA ' HD23 ' A' ' 27' ' ' LEU . 11.5 p-10 -55.96 -27.43 52.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.069 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 72.7 m -57.09 -22.77 42.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.174 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.433 ' HB ' ' CZ ' ' A' ' 22' ' ' PHE . 27.1 t -83.64 -45.65 18.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.312 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.841 HD23 ' HA ' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -59.09 -35.64 73.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.905 -179.798 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -57.29 -26.75 61.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.859 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -73.89 -45.36 51.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.881 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.582 HG23 ' CG1' ' A' ' 61' ' ' ILE . 9.2 p -78.74 -47.99 22.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.274 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.498 ' N ' HG13 ' A' ' 30' ' ' VAL . 1.4 mp -50.08 -35.95 11.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.928 0.394 . . . . 0.0 110.413 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.806 HD23 ' N ' ' A' ' 33' ' ' THR . 1.0 OUTLIER -52.76 -62.6 1.54 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.419 179.448 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.806 ' N ' HD23 ' A' ' 32' ' ' LEU . 72.3 m -51.41 -25.74 6.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.552 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 18.8 mt -73.58 -66.54 0.68 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.789 0.328 . . . . 0.0 110.933 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.6 mtt180 -60.21 -52.0 67.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.78 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.704 ' HE2' HD21 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -68.16 -14.31 62.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.405 179.849 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.528 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 3.0 ptmt 51.96 69.17 0.7 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.583 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.738 ' HB3' HG23 ' A' ' 33' ' ' THR . 7.2 tt0 -79.18 136.17 57.42 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.601 179.413 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.93 104.81 0.2 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.423 2.082 . . . . 0.0 112.104 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 64.0 mt -67.47 127.76 33.89 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.009 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -80.89 157.93 71.01 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.841 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -64.49 -26.97 62.24 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 122.505 2.137 . . . . 0.0 112.239 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -62.24 -23.71 66.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.033 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -62.52 -18.48 62.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.172 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 63.82 41.76 6.59 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.822 0.344 . . . . 0.0 110.983 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -77.39 87.32 3.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.766 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -134.65 -177.67 4.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.934 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -90.43 124.2 34.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.209 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.714 HD11 ' CD ' ' A' ' 58' ' ' GLU . 15.6 mt -68.47 -177.38 0.92 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.796 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.0 mmtp -125.12 156.98 37.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.917 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 78.88 -116.85 4.43 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.552 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.9 tppt? -61.18 -30.23 70.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.742 0.306 . . . . 0.0 111.098 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.433 ' CE3' HD13 ' A' ' 49' ' ' LEU . 5.5 m-90 -114.41 47.88 1.18 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.937 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 1.4 tttt -79.59 -50.99 1.23 Allowed Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.256 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 83.4 Cg_endo -82.35 11.21 3.25 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.534 2.156 . . . . 0.0 112.853 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.497 ' CD1' HD21 ' A' ' 79' ' ' LEU . 95.6 m-85 -118.49 174.65 6.13 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.759 0.314 . . . . 0.0 110.972 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -125.42 127.15 46.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.952 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.714 ' CD ' HD11 ' A' ' 49' ' ' LEU . 2.7 tt0 -95.98 156.38 16.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.742 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 16.5 t -160.02 131.97 6.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.785 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.4 m170 -111.04 90.83 3.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.964 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.582 ' CG1' HG23 ' A' ' 30' ' ' VAL . 4.0 mp -55.4 -24.64 16.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.716 179.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.444 ' HB2' ' CD ' ' A' ' 63' ' ' PRO . 1.6 ptmt -155.15 169.82 9.67 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.392 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.444 ' CD ' ' HB2' ' A' ' 62' ' ' LYS . 16.3 Cg_exo -68.26 3.79 1.92 Allowed 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.688 2.259 . . . . 0.0 113.325 -179.463 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -138.31 30.38 2.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.703 0.287 . . . . 0.0 111.225 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.794 ' O ' HD23 ' A' ' 66' ' ' LEU . 79.3 t -155.38 153.56 7.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.91 0.386 . . . . 0.0 111.244 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.794 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.2 OUTLIER -150.34 86.91 1.42 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.481 179.657 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.461 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 4.3 tp -85.47 109.05 18.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.948 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.54 ' CG1' HD22 ' A' ' 79' ' ' LEU . 57.4 t -84.61 135.26 25.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.669 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -143.25 155.03 44.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.97 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.719 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.5 OUTLIER -106.29 147.3 29.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.891 -179.879 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.747 ' HA ' HD12 ' A' ' 76' ' ' LEU . 26.4 t -101.54 116.69 45.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.155 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.62 162.76 14.04 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.791 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -44.19 -48.89 9.3 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.594 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -139.24 29.66 2.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.971 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.4 ' HG3' ' HB2' ' A' ' 3' ' ' LYS . 15.6 mp0 -160.35 171.41 19.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.72 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.747 HD12 ' HA ' ' A' ' 71' ' ' VAL . 7.6 tp -130.9 148.59 52.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.785 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.84 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.1 pp -135.27 137.89 49.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.33 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.628 HD11 HD11 ' A' ' 4' ' ' LEU . 76.0 mt -81.68 133.58 35.37 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.651 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.54 HD22 ' CG1' ' A' ' 68' ' ' VAL . 0.3 OUTLIER -88.93 -70.42 0.65 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.972 -179.753 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.471 ' HD2' HD21 ' A' ' 87' ' ' LEU . 0.1 OUTLIER -158.1 179.44 9.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.223 -179.901 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.587 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.1 tm? -132.93 128.22 36.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.742 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.587 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -166.83 168.63 40.35 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.591 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.46 ' C ' HD11 ' A' ' 66' ' ' LEU . 87.9 p -109.82 177.5 4.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.869 0.366 . . . . 0.0 110.71 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.496 ' N ' HD11 ' A' ' 66' ' ' LEU . 14.7 t-80 -60.72 -26.69 67.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.007 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.44 -28.76 52.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.042 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -89.77 -71.82 0.59 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.022 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.471 HD21 ' HD2' ' A' ' 80' ' ' ARG . 29.0 mt -58.44 -42.94 88.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.04 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.833 179.971 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.4 mt . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.809 0.338 . . . . 0.0 110.963 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -104.28 151.51 23.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.894 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.608 HD21 HD11 ' A' ' 78' ' ' LEU . 5.7 tp -117.89 143.36 46.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.869 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.748 ' HB2' HG22 ' A' ' 77' ' ' ILE . 2.3 t30 -130.06 171.69 12.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.878 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.2 mp -135.51 115.35 13.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.838 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.2 mmtm -82.9 169.59 15.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.772 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.0 tttt -59.94 -31.06 69.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.891 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.1 m -73.37 -46.4 49.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.888 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -61.02 -29.95 70.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.896 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -59.22 -53.72 55.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.939 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.483 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 0.6 OUTLIER -78.33 -16.69 57.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.02 0.438 . . . . 0.0 111.31 -179.961 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.44 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 8.4 m-20 -90.52 -17.71 26.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.886 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.56 ' O ' HD13 ' A' ' 18' ' ' LEU . 76.9 t80 -90.94 -68.34 0.8 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.335 -179.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.803 ' HA ' HD22 ' A' ' 18' ' ' LEU . 15.3 m-20 -90.82 -41.57 11.14 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -178.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.483 ' HB3' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -69.96 -23.92 63.25 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.205 -179.014 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.44 ' HB2' ' HA ' ' A' ' 13' ' ' ASP . 25.7 tp -73.07 -35.6 66.69 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.803 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.1 OUTLIER -58.08 -43.44 87.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.854 179.855 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 20.2 mt -79.81 -4.69 53.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.393 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.69 22.85 7.59 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.759 0.314 . . . . 0.0 111.153 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 96.78 23.04 16.48 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.823 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.499 ' CD1' HD12 ' A' ' 18' ' ' LEU . 11.1 t80 -114.19 137.45 51.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.813 0.34 . . . . 0.0 110.839 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.424 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 1.9 t0 -92.68 119.65 32.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.033 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -59.17 -19.01 41.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.473 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.4 p -46.82 -49.08 20.59 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 120.698 0.285 . . . . 0.0 111.309 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.459 HG13 ' HD2' ' A' ' 62' ' ' LYS . 21.7 t -74.53 -34.61 35.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.985 0.422 . . . . 0.0 111.111 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.68 ' CD1' HD13 ' A' ' 31' ' ' ILE . 5.6 tp -64.72 -39.01 92.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.722 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -54.85 -41.94 71.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.18 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.546 ' C ' HD22 ' A' ' 32' ' ' LEU . 3.5 mt-10 -69.8 -12.22 61.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.393 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.424 HG13 HD13 ' A' ' 61' ' ' ILE . 77.7 t -90.43 -70.94 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.847 0.356 . . . . 0.0 111.693 -179.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.68 HD13 ' CD1' ' A' ' 27' ' ' LEU . 1.4 mp -49.46 -40.0 14.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.036 -179.067 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.764 HD23 ' N ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -62.4 -14.63 42.47 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.369 -179.669 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.764 ' N ' HD23 ' A' ' 32' ' ' LEU . 92.9 m -90.08 -30.11 17.91 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.744 0.307 . . . . 0.0 110.866 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.9 mt -88.64 -31.63 18.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.398 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 31.8 mtm180 -93.21 20.21 7.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.338 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.464 ' O ' ' CG ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -123.47 24.46 8.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.831 0.348 . . . . 0.0 111.341 -179.821 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.464 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 3.9 pttp 46.71 47.21 15.01 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.319 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -123.82 109.89 29.9 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.786 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -66.35 135.75 40.88 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.396 2.064 . . . . 0.0 112.238 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.43 HD13 ' SG ' ' A' ' 59' ' ' CYS . 1.7 mt -64.03 -178.99 0.37 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.847 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.07 160.49 38.87 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.909 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.53 -18.34 48.85 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.601 2.201 . . . . 0.0 112.438 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.59 -1.64 38.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.523 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.445 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.3 m-85 -78.41 -3.01 41.12 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.61 0.243 . . . . 0.0 111.401 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 62.39 43.62 7.96 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.883 0.373 . . . . 0.0 110.866 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -88.43 100.46 13.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.907 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 75.7 m80 -133.22 173.37 11.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.95 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -81.09 131.86 35.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.072 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.763 HD11 ' HG3' ' A' ' 58' ' ' GLU . 7.1 mt -81.21 -178.78 7.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.875 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.21 157.09 41.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.879 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.42 ' C ' ' H ' ' A' ' 53' ' ' TRP . . . 60.31 109.93 0.01 OUTLIER Glycine 0 CA--C 1.508 -0.402 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.516 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 70.22 -44.87 0.58 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.667 0.27 . . . . 0.0 110.966 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.42 ' H ' ' C ' ' A' ' 51' ' ' GLY . 8.3 m95 -105.09 35.7 2.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.881 0.372 . . . . 0.0 110.887 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.456 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.1 OUTLIER -68.21 -52.82 20.86 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.141 179.975 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.456 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 71.6 Cg_endo -77.79 4.51 6.01 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.435 2.09 . . . . 0.0 112.699 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.782 ' CD2' HD13 ' A' ' 70' ' ' LEU . 30.6 m-85 -104.0 172.62 6.7 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.832 0.348 . . . . 0.0 110.806 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 57.1 ttm-85 -133.03 137.6 46.51 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.918 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.763 ' HG3' HD11 ' A' ' 49' ' ' LEU . 0.8 OUTLIER -98.96 172.32 7.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.863 -179.959 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.43 ' SG ' HD13 ' A' ' 40' ' ' LEU . 17.7 t -166.13 129.47 2.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.76 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.47 ' CE1' HD22 ' A' ' 66' ' ' LEU . 2.5 m-70 -99.52 84.38 2.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.067 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.672 HD11 ' HB3' ' A' ' 67' ' ' LEU . 2.9 mp -58.17 -28.32 34.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.031 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.459 ' HD2' HG13 ' A' ' 26' ' ' VAL . 14.7 mttt -137.34 168.26 17.32 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.658 -179.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.404 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 42.5 Cg_endo -67.61 -3.19 9.77 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.397 2.065 . . . . 0.0 112.824 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -145.04 28.6 1.23 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.656 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.901 ' O ' HD23 ' A' ' 66' ' ' LEU . 51.8 t -137.73 145.79 28.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.282 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.901 HD23 ' O ' ' A' ' 65' ' ' VAL . 6.7 mt -140.32 119.78 13.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.547 179.392 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.697 HD12 ' N ' ' A' ' 68' ' ' VAL . 4.8 tp -116.16 127.88 55.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.227 -179.489 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.697 ' N ' HD12 ' A' ' 67' ' ' LEU . 46.0 t -103.97 138.09 29.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.479 179.489 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.45 ' CD1' HD11 ' A' ' 76' ' ' LEU . 46.0 p90 -151.78 164.77 36.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.914 0.387 . . . . 0.0 110.993 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.782 HD13 ' CD2' ' A' ' 56' ' ' PHE . 4.3 tp -114.37 179.69 3.88 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.851 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.6 t -122.07 111.47 30.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.03 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.32 168.29 9.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.962 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -62.05 106.47 0.72 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.846 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.3 t0 58.4 21.6 8.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.103 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -156.6 147.79 22.19 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.85 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.45 HD11 ' CD1' ' A' ' 69' ' ' TYR . 7.2 tt -111.97 147.88 34.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.873 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.77 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.1 pp -130.76 135.66 59.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.227 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.608 HD11 HD21 ' A' ' 4' ' ' LEU . 89.4 mt -84.0 148.67 26.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.707 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.419 ' HG ' ' CD2' ' A' ' 56' ' ' PHE . 0.7 OUTLIER -103.45 -68.38 0.84 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.968 -179.89 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.65 171.09 19.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.073 0.464 . . . . 0.0 111.303 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.688 HD13 ' N ' ' A' ' 82' ' ' GLY . 1.2 tm? -124.57 131.92 53.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.683 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.688 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -150.6 -161.91 10.27 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.712 -179.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -139.39 168.84 18.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.81 0.338 . . . . 0.0 110.824 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.414 ' HA ' HD11 ' A' ' 66' ' ' LEU . 2.3 t-160 -59.23 -27.78 66.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.12 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.4 m -89.99 -18.62 25.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.302 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -84.66 -67.62 0.78 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.789 0.328 . . . . 0.0 111.233 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.589 HD13 HD12 ' A' ' 66' ' ' LEU . 7.0 mp -52.52 -32.1 38.8 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.327 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.885 -179.999 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.1 mp . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.904 0.383 . . . . 0.0 111.051 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.36 163.06 3.24 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.651 179.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.781 HD13 ' HA ' ' A' ' 35' ' ' ARG . 1.3 tt -125.65 145.27 50.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.889 0.376 . . . . 0.0 110.985 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.462 ' HB2' HG22 ' A' ' 77' ' ' ILE . 5.5 t-20 -134.15 -176.64 4.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.988 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.7 mt -145.76 136.14 24.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.907 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -104.89 171.41 7.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.816 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.43 -34.07 72.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.937 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.9 m -66.04 -31.55 72.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.915 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.8 t80 -77.26 -32.75 55.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.915 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 87.8 mm-40 -69.94 -28.98 66.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.155 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.5 pttt -90.15 -53.26 4.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.241 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -53.61 -25.51 17.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.032 0.444 . . . . 0.0 111.133 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.895 ' O ' HD13 ' A' ' 18' ' ' LEU . 51.6 t80 -64.14 -71.21 0.18 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.724 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.411 ' HA ' ' HB2' ' A' ' 18' ' ' LEU . 1.0 OUTLIER -68.0 -26.21 65.79 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.427 179.121 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.3 ttmm -69.97 -31.02 68.52 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.675 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.475 ' O ' ' HB3' ' A' ' 22' ' ' PHE . 33.2 tp -90.28 -40.32 12.22 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 179.089 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.895 HD13 ' O ' ' A' ' 14' ' ' PHE . 4.7 mp -53.45 -36.27 61.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.01 179.759 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.528 ' C ' HD12 ' A' ' 19' ' ' LEU . 4.5 pp -90.08 -9.89 46.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.525 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -93.48 37.17 1.06 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.656 0.265 . . . . 0.0 111.204 -179.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.81 23.03 40.24 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.843 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.577 ' CZ ' HG13 ' A' ' 26' ' ' VAL . 34.7 t80 -116.77 112.11 20.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.838 0.352 . . . . 0.0 110.783 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.466 ' O ' HG12 ' A' ' 26' ' ' VAL . 3.7 t0 -57.52 146.46 29.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.083 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.654 ' HA ' HD23 ' A' ' 27' ' ' LEU . 20.3 p-10 -86.31 -11.31 52.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.18 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.9 t -78.62 -27.27 45.45 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.7 0.286 . . . . 0.0 110.998 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.577 HG13 ' CZ ' ' A' ' 22' ' ' PHE . 10.0 p -80.02 -27.43 12.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.326 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.654 HD23 ' HA ' ' A' ' 24' ' ' ASP . 1.5 pp -59.13 -38.57 79.97 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.107 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 15.8 t30 -59.23 -23.9 62.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.176 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -80.05 -45.32 18.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.145 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.779 ' CG2' HD13 ' A' ' 61' ' ' ILE . 12.4 p -77.69 -48.39 24.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.45 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.838 ' HA ' HD12 ' A' ' 34' ' ' LEU . 1.2 mp -57.05 -29.72 32.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.901 0.381 . . . . 0.0 110.43 179.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.807 HD23 ' N ' ' A' ' 33' ' ' THR . 0.2 OUTLIER -61.36 -65.85 0.63 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.273 179.382 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.807 ' N ' HD23 ' A' ' 32' ' ' LEU . 85.4 m -46.23 -24.26 0.44 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.937 -179.72 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.838 HD12 ' HA ' ' A' ' 31' ' ' ILE . 3.3 mt -89.29 -49.79 6.51 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.781 ' HA ' HD13 ' A' ' 4' ' ' LEU . 35.3 mtt180 -83.26 -16.82 44.85 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -178.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.535 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -94.38 18.88 10.36 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.624 0.249 . . . . 0.0 111.45 -179.619 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.434 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 1.3 ptpp? 45.49 48.37 10.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.33 179.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.595 ' HB3' HG23 ' A' ' 33' ' ' THR . 2.8 tp10 -90.63 136.97 27.41 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.783 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -68.07 137.08 39.83 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.453 2.102 . . . . 0.0 112.288 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.635 HD22 ' SG ' ' A' ' 59' ' ' CYS . 2.6 mt -96.15 148.33 22.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.911 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.37 164.07 21.19 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.92 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.41 -29.66 45.24 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.578 2.185 . . . . 0.0 112.252 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -19.67 65.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.101 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.424 ' CE2' ' HA ' ' A' ' 61' ' ' ILE . 4.8 m-85 -62.64 -17.87 61.22 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.234 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 73.8 mm-40 66.73 38.72 3.8 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.874 0.368 . . . . 0.0 110.881 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -76.75 122.11 24.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.893 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -168.0 -178.08 3.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.877 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.19 134.76 36.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.027 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.2 mt -70.11 -176.64 1.19 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.928 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.78 -178.32 3.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.967 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 65.81 -140.47 40.4 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.528 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.0 -7.65 54.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.532 0.206 . . . . 0.0 111.369 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 5.0 m95 -96.17 37.6 1.24 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.88 0.372 . . . . 0.0 110.832 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.503 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -69.88 -50.24 17.82 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.407 179.997 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 64.0 Cg_endo -74.58 51.62 2.67 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.175 1.916 . . . . 0.0 112.66 -179.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.655 ' HD1' HD13 ' A' ' 70' ' ' LEU . 63.8 m-85 -152.99 175.59 12.79 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.761 179.585 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.24 144.62 44.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.922 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.502 ' OE2' HD22 ' A' ' 87' ' ' LEU . 2.1 tt0 -113.26 171.63 7.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.749 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.635 ' SG ' HD22 ' A' ' 40' ' ' LEU . 8.2 t -168.34 110.75 0.57 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.925 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.593 ' CD2' HD22 ' A' ' 66' ' ' LEU . 10.8 m170 -84.9 83.62 7.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.94 179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.779 HD13 ' CG2' ' A' ' 30' ' ' VAL . 4.0 mp -53.63 -27.59 15.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.037 179.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.487 ' NZ ' HG22 ' A' ' 26' ' ' VAL . 0.0 OUTLIER -159.49 169.74 9.93 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.382 179.714 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.434 ' CD ' ' HB2' ' A' ' 62' ' ' LYS . 15.3 Cg_exo -68.77 5.52 1.31 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.705 2.27 . . . . 0.0 113.29 -179.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -138.9 24.69 2.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.56 0.219 . . . . 0.0 111.39 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.871 ' O ' HD23 ' A' ' 66' ' ' LEU . 42.0 t -155.35 145.68 12.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 121.036 0.446 . . . . 0.0 111.603 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.871 HD23 ' O ' ' A' ' 65' ' ' VAL . 15.7 mt -141.68 107.52 5.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.428 179.506 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.641 ' C ' HD13 ' A' ' 67' ' ' LEU . 2.5 tm? -99.84 134.05 43.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.933 0.397 . . . . 0.0 111.365 -179.608 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.524 ' H ' HD22 ' A' ' 67' ' ' LEU . 98.6 t -113.12 119.93 61.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.879 178.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.56 ' HB3' HD11 ' A' ' 67' ' ' LEU . 20.3 p90 -132.97 155.7 48.65 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.953 0.406 . . . . 0.0 111.323 -179.001 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.807 ' HB2' HD11 ' A' ' 77' ' ' ILE . 6.6 tp -109.54 171.09 7.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.852 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 20.2 t -122.93 104.98 15.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.262 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.0 164.41 24.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.776 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -41.94 -36.19 1.03 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.55 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -157.48 27.63 0.29 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.864 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -151.36 162.75 40.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.816 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.441 HD11 ' CD2' ' A' ' 69' ' ' TYR . 6.5 tp -114.03 147.6 38.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.583 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.807 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.2 pp -136.4 126.55 40.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.373 -179.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 78.5 mt -80.32 115.68 19.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.55 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.554 HD23 ' NH1' ' A' ' 80' ' ' ARG . 0.5 OUTLIER -72.5 -66.58 0.64 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.09 -179.82 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.599 ' O ' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -163.77 176.06 9.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.049 0.452 . . . . 0.0 111.331 179.802 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.767 HD11 HG13 ' A' ' 65' ' ' VAL . 1.4 tm? -131.86 117.44 18.51 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.714 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.483 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -120.71 -161.15 11.34 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.58 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.8 m -134.19 153.01 52.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.069 0.461 . . . . 0.0 110.912 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.848 ' HA ' HD11 ' A' ' 66' ' ' LEU . 0.6 OUTLIER -49.42 -28.48 5.23 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.344 -179.795 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 12.7 t -90.19 -20.67 22.77 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.239 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.5 -71.22 0.47 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.152 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.703 HD13 HD12 ' A' ' 66' ' ' LEU . 4.3 mp -49.93 -27.46 5.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.372 -179.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.215 -0.897 . . . . 0.0 110.916 179.982 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 7.1 mt . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.789 0.328 . . . . 0.0 111.008 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.85 146.94 40.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.874 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.405 HD21 HH21 ' A' ' 35' ' ' ARG . 0.6 OUTLIER -118.2 148.3 42.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.912 179.87 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.775 ' HB2' HG22 ' A' ' 77' ' ' ILE . 4.6 t30 -133.56 171.14 14.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.917 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.1 mt -137.97 104.13 5.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.9 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -78.41 165.94 23.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.816 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -60.39 -38.85 85.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.812 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.8 t -68.85 -31.45 70.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.924 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.474 ' CZ ' HD13 ' A' ' 78' ' ' LEU . 56.0 t80 -80.92 -37.34 29.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.936 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -57.22 -36.33 70.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.974 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.472 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 4.7 mtpm? -90.06 -17.87 26.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.14 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.452 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 3.9 m-20 -90.53 -17.26 27.34 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.276 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.568 ' O ' HD13 ' A' ' 18' ' ' LEU . 65.9 t80 -91.1 -68.43 0.79 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.425 -179.658 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.796 ' HA ' HD22 ' A' ' 18' ' ' LEU . 1.3 t0 -90.95 -40.9 11.43 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.472 ' HB3' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -70.36 -26.46 63.74 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.677 -0.409 . . . . 0.0 111.086 -179.117 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.452 ' HB2' ' HA ' ' A' ' 13' ' ' ASP . 20.5 tp -69.8 -33.32 72.2 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 179.012 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.796 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.1 OUTLIER -61.36 -30.77 70.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.802 179.904 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 21.6 mt -86.36 -32.8 20.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.066 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -60.89 -19.48 60.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.075 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 133.04 34.04 0.35 Allowed Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.574 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.482 ' HB3' ' HA ' ' A' ' 18' ' ' LEU . 12.1 t80 -113.2 146.51 39.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.737 0.303 . . . . 0.0 110.726 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.432 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 43.0 t0 -95.08 106.79 18.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.012 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -51.91 -24.99 7.13 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.317 -179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -50.68 -44.06 57.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.788 0.328 . . . . 0.0 111.158 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.6 t -77.28 -35.82 23.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.003 0.43 . . . . 0.0 111.059 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.662 HD11 HD13 ' A' ' 31' ' ' ILE . 3.9 tp -59.79 -40.31 87.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.641 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.439 ' O ' HD22 ' A' ' 32' ' ' LEU . 34.0 t30 -55.94 -42.45 76.19 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.053 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.53 ' C ' HD22 ' A' ' 32' ' ' LEU . 5.9 mm-40 -61.77 -16.62 51.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.4 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.479 ' CG1' HD13 ' A' ' 61' ' ' ILE . 60.8 t -90.33 -70.4 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.814 0.34 . . . . 0.0 111.807 -179.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.662 HD13 HD11 ' A' ' 27' ' ' LEU . 1.2 mp -50.66 -36.47 14.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.121 -0.49 . . . . 0.0 112.219 -178.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.721 HD23 ' N ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -67.24 -11.19 56.8 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 120.909 -0.316 . . . . 0.0 111.352 -179.869 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.721 ' N ' HD23 ' A' ' 32' ' ' LEU . 86.3 m -90.57 -35.84 14.8 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.925 0.393 . . . . 0.0 111.048 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.432 ' CD2' HD21 ' A' ' 40' ' ' LEU . 8.7 mt -90.06 -65.04 1.05 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.912 -179.137 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.442 ' HD2' HG23 ' A' ' 31' ' ' ILE . 12.2 mtt180 -49.54 -21.99 1.13 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.106 -179.129 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.544 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -90.49 21.25 4.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.638 0.256 . . . . 0.0 111.526 -179.882 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.438 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 0.2 OUTLIER 46.1 61.66 2.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.007 0.432 . . . . 0.0 111.513 -179.935 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -119.58 144.07 36.07 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.746 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.0 141.56 40.46 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.423 2.082 . . . . 0.0 112.379 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.716 HD22 ' CE2' ' A' ' 44' ' ' PHE . 54.0 mt -84.73 141.07 30.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.925 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.29 159.47 77.67 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.874 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -61.55 -27.03 81.38 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.603 2.202 . . . . 0.0 112.241 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -64.21 -26.54 68.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.971 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.716 ' CE2' HD22 ' A' ' 40' ' ' LEU . 3.1 m-30 -58.25 -53.53 57.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.76 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 60.91 83.53 0.14 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.959 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -92.53 105.35 17.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.878 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -130.69 -177.2 4.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.914 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -95.07 136.65 35.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.087 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.807 HD13 ' HB3' ' A' ' 53' ' ' TRP . 1.5 mp -70.11 -168.38 0.21 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.84 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.3 mmtt -137.8 150.34 47.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.791 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 60.39 110.52 0.01 OUTLIER Glycine 0 CA--C 1.507 -0.413 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.655 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.7 tptm 70.15 -45.67 0.59 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.713 0.292 . . . . 0.0 110.953 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.807 ' HB3' HD13 ' A' ' 49' ' ' LEU . 90.9 m95 -98.95 33.25 2.4 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.964 0.412 . . . . 0.0 110.822 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.484 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 1.3 tttm -70.1 -49.41 18.6 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.673 -179.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.484 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 72.9 Cg_endo -77.31 5.85 4.79 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.419 2.079 . . . . 0.0 113.191 -179.481 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -110.06 173.36 6.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.824 0.345 . . . . 0.0 110.959 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.755 ' O ' HG13 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -129.04 144.53 51.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.956 -179.858 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.657 ' HG3' HG22 ' A' ' 68' ' ' VAL . 4.1 tt0 -106.45 179.36 4.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.888 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.6 t -170.96 120.99 0.54 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.834 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.404 ' CD2' ' N ' ' A' ' 60' ' ' HIS . 13.7 m170 -99.2 78.66 2.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.976 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.538 HD11 ' HB3' ' A' ' 67' ' ' LEU . 2.9 mp -59.6 -29.14 41.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.113 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.475 ' HB2' HG23 ' A' ' 65' ' ' VAL . 14.1 mtpt -135.84 168.73 16.02 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.85 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.405 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 12.1 Cg_exo -70.03 -1.08 8.1 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.871 2.38 . . . . 0.0 112.931 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 -143.06 26.66 1.66 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.704 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.79 ' O ' HD23 ' A' ' 66' ' ' LEU . 42.8 t -137.26 150.93 26.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.107 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.868 HD12 HD12 ' A' ' 87' ' ' LEU . 1.1 mt -147.91 87.5 1.62 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.614 179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.74 HD12 ' N ' ' A' ' 68' ' ' VAL . 6.4 tp -82.94 134.31 35.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.115 -179.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.755 HG13 ' O ' ' A' ' 57' ' ' ARG . 38.8 t -113.38 140.29 34.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.665 179.69 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 52.1 p90 -155.49 162.86 40.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.111 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.69 ' HB2' HD11 ' A' ' 77' ' ' ILE . 2.2 tp -112.35 173.08 6.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.833 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -127.42 102.33 8.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.205 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.34 164.57 26.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.798 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -43.44 -43.91 5.54 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.58 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -145.12 26.39 1.34 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.994 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -150.46 167.36 27.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.798 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.1 tt -126.15 134.81 51.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.727 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.775 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.4 pp -125.73 132.53 70.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.446 -179.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.474 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 92.5 mt -77.8 139.28 39.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.605 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -94.0 -64.56 1.07 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.013 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.484 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.2 OUTLIER -168.75 171.47 8.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.988 0.423 . . . . 0.0 111.206 -179.949 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.508 ' C ' HD13 ' A' ' 81' ' ' LEU . 2.7 tm? -128.54 121.61 29.18 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.696 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.479 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -137.42 -165.97 10.59 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.642 -0.789 . . . . 0.0 112.575 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.4 m -152.43 -171.55 3.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.904 0.383 . . . . 0.0 110.822 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 -73.39 -28.45 62.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.044 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.47 -23.21 22.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.13 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -89.89 -68.75 0.76 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.984 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.868 HD12 HD12 ' A' ' 66' ' ' LEU . 72.8 mt -59.1 -42.84 91.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.94 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.226 -0.892 . . . . 0.0 110.911 -179.959 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 21.0 mt . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.838 0.352 . . . . 0.0 110.961 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.86 150.98 26.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.866 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.5 tt -122.08 144.89 48.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.977 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.656 ' HB2' HG22 ' A' ' 77' ' ' ILE . 5.9 t30 -130.56 179.18 6.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.955 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -140.64 121.87 14.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.911 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -92.87 168.85 10.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.929 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -65.53 -41.17 93.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.836 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.72 -32.83 74.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.856 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.562 ' HE1' HD13 ' A' ' 67' ' ' LEU . 51.8 t80 -69.72 -30.87 68.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.873 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -63.88 -50.82 67.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.946 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.564 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 46.6 mttp -76.5 -14.16 60.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.993 0.425 . . . . 0.0 111.264 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.447 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 3.8 m-20 -90.42 -11.78 39.42 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.798 179.551 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.865 ' O ' HD13 ' A' ' 18' ' ' LEU . 37.1 t80 -90.77 -74.97 0.48 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.138 -179.687 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -90.39 -31.79 16.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.842 -179.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.564 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -77.03 -13.1 60.0 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.626 -0.429 . . . . 0.0 110.816 -179.948 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.474 HD12 ' HB3' ' A' ' 20' ' ' ASN . 27.2 tp -86.98 -30.99 20.84 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 178.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.865 HD13 ' O ' ' A' ' 14' ' ' PHE . 4.2 mp -45.57 -51.27 12.22 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.309 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.5 pp -72.42 -6.44 43.55 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.001 -179.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.474 ' HB3' HD12 ' A' ' 17' ' ' LEU . 21.2 t30 -93.29 37.63 1.04 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.745 0.307 . . . . 0.0 111.051 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.73 23.11 70.6 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.24 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.685 ' CD1' HD12 ' A' ' 18' ' ' LEU . 51.7 t80 -109.78 124.78 51.88 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.833 0.349 . . . . 0.0 110.832 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.504 ' HB3' HG12 ' A' ' 26' ' ' VAL . 18.0 t0 -64.67 141.36 58.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.927 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.894 ' HA ' HD23 ' A' ' 27' ' ' LEU . 2.4 p30 -94.0 -20.62 19.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.352 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.6 m -76.64 -26.43 54.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.831 0.348 . . . . 0.0 111.286 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.504 HG12 ' HB3' ' A' ' 23' ' ' ASP . 13.7 p -78.76 -33.29 16.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.373 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.894 HD23 ' HA ' ' A' ' 24' ' ' ASP . 1.3 pp -62.04 -36.95 83.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.043 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.56 ' O ' HD22 ' A' ' 32' ' ' LEU . 43.2 t-20 -58.89 -24.81 62.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.046 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.407 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 9.8 mt-10 -75.62 -33.95 60.54 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.1 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.697 HG13 HD12 ' A' ' 31' ' ' ILE . 11.4 p -90.7 -34.52 6.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.557 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.697 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -70.56 -48.05 61.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.749 -179.339 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.747 HD23 ' N ' ' A' ' 33' ' ' THR . 0.5 OUTLIER -60.19 -16.08 29.98 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.523 0.194 . . . . 0.0 111.523 -179.395 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.747 ' N ' HD23 ' A' ' 32' ' ' LEU . 88.6 m -90.18 -26.63 20.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.659 0.266 . . . . 0.0 111.115 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.5 mt -87.32 -46.72 9.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.398 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 68.8 mtp180 -74.22 -5.49 42.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.794 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.497 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -97.97 25.29 6.14 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.757 0.313 . . . . 0.0 111.438 -179.661 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.471 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 53.6 pttt 46.53 29.96 1.01 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.24 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -90.25 130.55 41.56 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.791 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -75.89 148.94 32.56 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.442 2.095 . . . . 0.0 112.422 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.489 HD13 ' SG ' ' A' ' 59' ' ' CYS . 16.0 mt -90.59 142.24 27.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.888 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.429 ' HB2' ' CE1' ' A' ' 44' ' ' PHE . 1.6 m-20 -73.71 157.25 87.72 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.03 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.6 -9.76 26.47 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.604 2.203 . . . . 0.0 112.557 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -96.23 30.97 2.31 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.766 0.317 . . . . 0.0 110.94 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.439 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.3 m-30 -100.42 -11.17 20.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.305 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 65.95 44.92 2.6 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.851 0.358 . . . . 0.0 110.925 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.9 p-10 -89.15 76.93 7.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.888 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -119.82 176.79 5.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.915 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.91 136.25 38.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.064 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.561 ' H ' HD12 ' A' ' 49' ' ' LEU . 2.5 mp -78.13 -172.69 2.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.914 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.0 mmtm -130.41 171.39 13.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.95 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.19 -128.17 11.47 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.5 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.7 mmtp -69.98 -23.25 63.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.705 0.288 . . . . 0.0 110.978 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 18.9 m-90 -96.68 31.82 2.22 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.889 0.376 . . . . 0.0 110.998 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.446 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.2 OUTLIER -66.12 -51.45 45.3 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.064 179.905 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 98.7 Cg_endo -80.09 46.56 2.27 Favored 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.422 2.081 . . . . 0.0 112.487 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -154.96 179.11 9.44 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.918 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 -139.69 138.98 36.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.872 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.434 ' HG3' HG22 ' A' ' 68' ' ' VAL . 2.1 tt0 -98.44 176.77 5.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.489 ' SG ' HD13 ' A' ' 40' ' ' LEU . 12.0 t -170.72 102.64 0.24 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.881 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.697 ' CD2' HD22 ' A' ' 66' ' ' LEU . 10.7 m170 -83.2 82.98 8.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.032 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.589 HG21 HG23 ' A' ' 30' ' ' VAL . 2.7 mp -61.65 -35.12 65.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.077 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.417 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 7.6 mmmt -131.03 169.32 14.02 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.673 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.417 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 16.9 Cg_exo -66.83 -5.29 12.95 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.634 2.223 . . . . 0.0 112.79 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -142.92 27.48 1.63 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.829 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.909 ' O ' HD23 ' A' ' 66' ' ' LEU . 98.0 t -135.52 137.98 48.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.177 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.909 HD23 ' O ' ' A' ' 65' ' ' VAL . 9.0 mt -139.86 93.79 2.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.794 179.559 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.64 HD12 ' N ' ' A' ' 68' ' ' VAL . 2.6 tp -92.36 119.24 31.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.844 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.64 ' N ' HD12 ' A' ' 67' ' ' LEU . 50.3 t -93.74 136.05 26.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.021 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.428 ' CZ ' ' HB2' ' A' ' 59' ' ' CYS . 2.2 p90 -147.8 158.61 44.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.759 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.741 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.4 OUTLIER -104.28 144.35 31.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.866 -179.968 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.521 ' HA ' HD12 ' A' ' 76' ' ' LEU . 8.7 p -82.83 158.96 3.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.021 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.506 ' N ' HG22 ' A' ' 71' ' ' VAL . 0.0 OUTLIER -157.44 155.84 31.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.926 179.599 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.67 107.29 0.49 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.003 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 58.29 23.41 10.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.116 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -158.1 154.66 27.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.886 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.521 HD12 ' HA ' ' A' ' 71' ' ' VAL . 4.6 tp -133.89 140.24 46.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.723 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.741 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.0 pp -122.64 134.61 65.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.189 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 71.3 mt -74.19 151.94 39.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.912 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.735 HD12 HH11 ' A' ' 80' ' ' ARG . 0.2 OUTLIER -112.62 -68.62 0.92 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.884 179.976 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.735 HH11 HD12 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -158.62 168.81 25.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.078 179.999 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.659 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.3 tm? -118.63 133.95 55.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.733 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.659 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -150.3 -164.57 11.96 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.58 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.4 p -144.48 171.78 13.88 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.724 0.297 . . . . 0.0 110.832 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.579 ' HA ' HD11 ' A' ' 66' ' ' LEU . 2.5 t-80 -58.65 -28.33 65.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.016 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.2 t -86.38 -30.05 22.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.94 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.37 -74.93 0.31 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.906 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.745 HD12 ' HB2' ' A' ' 66' ' ' LEU . 34.7 mt -60.25 -34.61 73.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.854 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.85 179.982 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.1 mt . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.722 0.296 . . . . 0.0 110.98 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.66 156.47 13.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.908 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.789 HD11 HD11 ' A' ' 78' ' ' LEU . 7.1 tt -124.68 151.37 45.03 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.977 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.662 ' HB2' HG22 ' A' ' 77' ' ' ILE . 1.4 t-20 -138.13 174.28 10.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.852 179.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.0 mt -127.67 142.58 51.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.871 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.5 mmpt? -112.93 164.55 13.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.907 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.3 pttt -54.71 -53.21 57.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.183 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.41 ' CB ' ' HB3' ' A' ' 80' ' ' ARG . 55.8 m -57.62 -37.68 73.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.121 -179.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.471 ' CZ ' HD13 ' A' ' 78' ' ' LEU . 36.0 t80 -62.45 -27.69 69.29 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.99 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -77.7 -38.47 47.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.092 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.412 ' O ' ' CB ' ' A' ' 16' ' ' LYS . 6.1 ptmt -89.96 -8.59 51.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.601 -179.778 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -90.44 -23.52 20.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.792 0.33 . . . . 0.0 111.116 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.591 ' HZ ' HD13 ' A' ' 27' ' ' LEU . 37.1 t80 -90.29 -68.86 0.76 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.439 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -49.96 -33.07 16.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.995 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.412 ' CB ' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -79.45 -23.66 42.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.862 179.715 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.454 ' HG ' ' CG ' ' A' ' 22' ' ' PHE . 36.6 tp -86.46 -50.53 6.81 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.689 HD13 ' HD2' ' A' ' 22' ' ' PHE . 4.2 mm? -50.55 -36.08 32.77 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.1 179.749 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 27.0 mt -90.01 -7.75 53.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.798 -179.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -93.77 35.85 1.12 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.877 0.37 . . . . 0.0 111.149 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 80.11 22.85 62.42 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.684 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.689 ' HD2' HD13 ' A' ' 18' ' ' LEU . 71.7 t80 -98.72 107.96 20.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.783 0.325 . . . . 0.0 110.609 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.751 ' HB3' HG23 ' A' ' 26' ' ' VAL . 2.2 t0 -52.77 124.13 13.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.037 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.58 ' HA ' HD23 ' A' ' 27' ' ' LEU . 7.4 p-10 -62.43 -38.4 89.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.119 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.6 t -54.1 -24.59 18.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.245 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.751 HG23 ' HB3' ' A' ' 23' ' ' ASP . 34.5 t -79.61 -35.48 16.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.286 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.591 HD13 ' HZ ' ' A' ' 14' ' ' PHE . 1.0 OUTLIER -57.67 -35.99 71.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.954 -179.871 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.734 ' O ' HD22 ' A' ' 32' ' ' LEU . 6.1 t-20 -63.7 -15.86 59.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.36 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -90.1 -35.58 15.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.694 0.283 . . . . 0.0 111.328 -179.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.765 ' CG2' HD13 ' A' ' 61' ' ' ILE . 10.0 p -90.63 -36.05 7.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -179.325 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.643 ' CD1' HG13 ' A' ' 30' ' ' VAL . 1.6 mp -76.21 -42.07 37.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 111.642 0.238 . . . . 0.0 111.642 -179.163 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.761 HD23 ' N ' ' A' ' 33' ' ' THR . 0.4 OUTLIER -64.51 -14.37 56.97 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.447 -179.553 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.761 ' N ' HD23 ' A' ' 32' ' ' LEU . 99.9 m -90.36 -25.68 20.32 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 120.767 0.317 . . . . 0.0 110.904 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.8 mt -86.3 -36.78 19.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.555 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.6 mtp-105 -93.5 20.36 7.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.643 -179.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.54 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -126.85 18.71 7.24 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.598 0.222 . . . . 0.0 111.598 -179.793 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.458 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 12.4 pttm 45.72 30.01 0.76 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.907 0.384 . . . . 0.0 111.085 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.02 148.13 78.11 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.9 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -74.44 161.4 40.19 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.5 2.133 . . . . 0.0 112.463 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.2 mt -130.14 123.4 30.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.991 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.61 156.91 29.86 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.914 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -62.34 -24.17 75.63 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.543 2.162 . . . . 0.0 112.281 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.51 -23.7 67.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.037 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.423 ' O ' ' CD2' ' A' ' 60' ' ' HIS . 44.6 m-85 -69.34 -10.54 58.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.455 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 58.91 34.69 23.79 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.861 0.362 . . . . 0.0 111.066 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -66.4 78.11 0.1 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.837 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 73.1 m80 -138.95 177.62 7.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.019 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.31 137.02 44.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.09 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.537 HD13 ' HB3' ' A' ' 53' ' ' TRP . 0.4 OUTLIER -74.89 -171.09 1.22 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.819 179.906 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -144.1 149.78 37.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.929 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 65.98 109.17 0.01 OUTLIER Glycine 0 CA--C 1.506 -0.474 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.841 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.4 mptt 69.18 -45.95 0.56 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.528 0.204 . . . . 0.0 111.181 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.537 ' HB3' HD13 ' A' ' 49' ' ' LEU . 17.8 m95 -101.95 33.93 2.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.855 0.359 . . . . 0.0 111.073 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.464 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 22.9 tttm -64.15 -49.42 73.66 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.303 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.464 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 89.1 Cg_endo -79.76 46.89 2.35 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.362 2.041 . . . . 0.0 112.745 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.551 ' CE1' HD11 ' A' ' 79' ' ' LEU . 69.1 m-85 -153.02 -176.51 5.8 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.732 0.301 . . . . 0.0 110.962 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.407 ' HB2' ' NH1' ' A' ' 57' ' ' ARG . 18.5 ttm105 -137.33 141.99 41.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.153 -179.749 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -106.81 161.97 14.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.793 179.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 9.1 t -171.27 100.24 0.2 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.906 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.44 ' O ' ' CG ' ' A' ' 60' ' ' HIS . 26.8 p80 -86.58 108.56 18.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.067 0.461 . . . . 0.0 110.827 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.765 HD13 ' CG2' ' A' ' 30' ' ' VAL . 4.6 mp -77.53 -31.9 18.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.852 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.538 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 5.6 mmtp -128.05 161.5 55.61 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.293 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.538 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 29.0 Cg_endo -62.98 -6.02 8.73 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.307 2.005 . . . . 0.0 112.747 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -135.84 25.81 3.34 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.694 179.556 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.863 ' O ' HD23 ' A' ' 66' ' ' LEU . 54.8 t -137.33 146.76 27.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.137 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.863 HD23 ' O ' ' A' ' 65' ' ' VAL . 4.7 mt -144.25 102.94 3.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.731 179.6 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.649 ' C ' HD13 ' A' ' 67' ' ' LEU . 3.3 tm? -92.58 131.19 37.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.008 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.604 ' N ' HD13 ' A' ' 67' ' ' LEU . 87.5 t -109.84 115.59 50.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.828 178.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.485 ' HB3' HD11 ' A' ' 67' ' ' LEU . 27.2 p90 -128.19 149.96 50.22 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.268 -179.073 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.793 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.4 OUTLIER -113.73 155.23 25.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.857 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.578 ' H ' HD23 ' A' ' 70' ' ' LEU . 21.5 t -107.04 129.95 59.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.176 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.47 173.2 7.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.784 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -56.92 101.93 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.912 0.387 . . . . 0.0 110.981 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 54.85 23.48 4.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.149 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -150.68 133.91 16.2 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.938 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.464 HD12 ' HA ' ' A' ' 71' ' ' VAL . 6.6 tp -105.04 152.09 23.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.755 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.793 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.0 pp -138.29 142.89 34.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.429 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.789 HD11 HD11 ' A' ' 4' ' ' LEU . 58.1 mt -93.81 123.31 37.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.434 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.589 HD11 HD12 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -77.44 -60.37 2.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.078 -179.635 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.41 ' HB3' ' CB ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -173.87 167.05 4.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.081 0.467 . . . . 0.0 111.65 179.949 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.898 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.9 tm? -116.8 143.52 45.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.582 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.898 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -165.93 -165.63 23.59 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.841 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.0 p -138.84 -178.84 5.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.764 0.316 . . . . 0.0 110.795 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -62.89 -23.42 67.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.182 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.7 m -83.29 -30.19 27.76 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.163 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -86.03 -67.95 0.77 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.014 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.485 HD13 HD12 ' A' ' 66' ' ' LEU . 4.6 mp -56.15 -32.39 64.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.055 -179.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.941 -179.96 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 7.1 mt . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.924 0.393 . . . . 0.0 110.835 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.61 145.95 50.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.824 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -113.59 151.43 31.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.945 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.829 ' HB2' HG22 ' A' ' 77' ' ' ILE . 2.7 t30 -137.13 -173.01 3.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.764 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.0 mp -144.73 136.84 26.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.976 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.55 172.7 6.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.938 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.2 mtmt -67.96 -46.16 72.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.949 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 35.3 m -59.69 -42.41 92.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.872 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.509 ' CE1' HD13 ' A' ' 67' ' ' LEU . 11.5 t80 -60.54 -36.85 79.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.746 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -63.53 -47.47 81.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.845 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.578 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 9.7 mttt -72.6 -23.47 60.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.102 0.477 . . . . 0.0 111.027 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.428 ' C ' ' HB2' ' A' ' 17' ' ' LEU . 82.7 m-20 -90.41 -10.28 44.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.057 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.559 ' O ' HD21 ' A' ' 18' ' ' LEU . 10.1 t80 -90.85 -68.4 0.79 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.904 179.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -91.38 -36.7 13.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.214 -179.489 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.578 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 2.1 ttmt -76.21 -16.58 59.8 Favored 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 120.89 -0.324 . . . . 0.0 111.689 -178.709 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.431 HD22 ' HB2' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -81.88 -35.31 29.4 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.137 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.821 HD13 ' CB ' ' A' ' 24' ' ' ASP . 1.4 mt -61.53 -35.76 78.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.952 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 pp -89.93 11.58 20.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.348 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -114.06 28.69 8.56 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.859 0.362 . . . . 0.0 110.945 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.04 25.03 32.84 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.647 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.441 ' CD2' ' N ' ' A' ' 23' ' ' ASP . 50.9 t80 -115.09 164.22 14.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.775 0.321 . . . . 0.0 110.872 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.633 ' HB3' HG23 ' A' ' 26' ' ' VAL . 11.9 t70 -98.65 114.99 27.69 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.965 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.821 ' CB ' HD13 ' A' ' 18' ' ' LEU . 6.8 p-10 -66.44 -31.16 71.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.893 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.1 t -56.7 -37.0 70.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.186 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.633 HG23 ' HB3' ' A' ' 23' ' ' ASP . 46.9 t -60.76 -35.71 66.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.204 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.442 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.6 OUTLIER -65.48 -33.76 76.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.791 -179.815 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.819 ' O ' HD22 ' A' ' 32' ' ' LEU . 8.1 t-20 -65.9 -14.38 61.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.4 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.445 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 3.1 mt-10 -90.14 -33.76 16.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.731 0.301 . . . . 0.0 111.113 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 1.13 HG23 HG21 ' A' ' 61' ' ' ILE . 8.0 p -90.82 -43.06 14.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.659 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.753 HD12 HG13 ' A' ' 30' ' ' VAL . 1.6 mp -62.26 -57.73 10.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.639 -179.248 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.819 HD22 ' O ' ' A' ' 28' ' ' ASN . 0.9 OUTLIER -49.55 -21.43 0.98 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -178.855 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.669 ' N ' HD23 ' A' ' 32' ' ' LEU . 89.1 m -90.08 -34.23 16.0 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.676 0.274 . . . . 0.0 111.24 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.85 HD21 HD21 ' A' ' 40' ' ' LEU . 83.0 mt -86.43 -30.84 21.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.668 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.491 ' HG3' HG23 ' A' ' 31' ' ' ILE . 2.2 mtt85 -92.38 20.18 6.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.745 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.591 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -113.74 -50.94 2.82 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.796 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.543 ' H ' ' HG3' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 153.93 -20.65 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 122.699 0.4 . . . . 0.0 111.008 179.752 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.458 ' OE1' HG23 ' A' ' 33' ' ' THR . 24.4 tt0 -64.08 111.44 5.44 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.173 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -78.82 131.48 10.19 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.508 2.139 . . . . 0.0 112.273 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.85 HD21 HD21 ' A' ' 34' ' ' LEU . 6.7 mt -59.57 166.95 2.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.926 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -108.73 163.28 17.33 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.09 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.94 -12.75 31.08 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.618 2.212 . . . . 0.0 112.545 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 -82.91 2.95 31.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.374 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -95.23 20.97 8.47 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.708 0.29 . . . . 0.0 111.185 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 61.18 46.72 7.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.897 0.379 . . . . 0.0 111.037 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.4 p-10 -89.52 96.61 10.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.937 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 21.6 p-80 -152.08 -178.07 6.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.931 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -87.02 128.48 35.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.13 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.599 ' H ' HD12 ' A' ' 49' ' ' LEU . 4.6 mp -65.62 -175.78 0.3 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.889 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.1 mtmt -117.34 161.19 19.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.898 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.95 -116.52 4.68 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.575 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.14 -14.75 21.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.601 0.239 . . . . 0.0 111.313 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 19.3 m95 -96.24 31.08 2.28 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.061 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.4 OUTLIER -75.53 -51.44 3.2 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.028 179.844 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 50.9 Cg_exo -54.01 -18.69 13.83 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.424 2.082 . . . . 0.0 112.437 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -98.89 175.07 6.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.854 0.359 . . . . 0.0 110.992 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.653 HH21 HG21 ' A' ' 71' ' ' VAL . 0.3 OUTLIER -128.61 132.54 48.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.877 179.888 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.447 ' HG3' HD21 ' A' ' 49' ' ' LEU . 2.4 tt0 -95.96 172.76 7.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.072 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 3.2 t -170.18 116.19 0.52 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.638 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.6 m170 -88.57 84.62 6.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.111 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 1.13 HG21 HG23 ' A' ' 30' ' ' VAL . 3.5 mp -59.05 -27.89 37.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.85 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.439 ' HB2' HG23 ' A' ' 65' ' ' VAL . 7.1 mttp -139.62 168.92 13.47 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.538 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.418 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 17.2 Cg_exo -66.92 -2.93 8.65 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.653 2.235 . . . . 0.0 112.884 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -145.42 29.56 1.15 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.914 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.88 ' O ' HD23 ' A' ' 66' ' ' LEU . 42.2 t -139.6 151.25 22.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.215 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.88 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.0 OUTLIER -157.09 104.09 2.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.595 179.812 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.509 HD13 ' CE1' ' A' ' 10' ' ' PHE . 1.1 tp -105.2 116.65 32.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.669 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.446 HG22 ' HG3' ' A' ' 58' ' ' GLU . 34.1 t -85.43 141.86 13.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.222 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.637 ' CD1' HD11 ' A' ' 76' ' ' LEU . 38.3 p90 -147.41 163.6 35.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.963 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.762 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.3 OUTLIER -112.82 157.14 21.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.867 179.98 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.663 ' H ' HD23 ' A' ' 70' ' ' LEU . 21.5 t -111.44 115.02 48.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.099 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.1 163.62 16.13 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.857 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -42.75 -35.61 1.2 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.55 -179.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -156.62 26.53 0.34 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.084 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -149.37 155.88 41.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.768 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.637 HD11 ' CD1' ' A' ' 69' ' ' TYR . 9.8 tp -113.73 132.16 55.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.723 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.829 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.2 pp -126.3 130.39 71.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.367 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 72.7 mt -74.13 142.18 45.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.637 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.82 -75.55 0.56 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.169 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.5 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -146.95 179.6 7.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.84 0.352 . . . . 0.0 111.287 -179.724 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.597 ' C ' HD13 ' A' ' 81' ' ' LEU . 2.9 tm? -139.6 134.9 32.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.765 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.516 ' H ' HD22 ' A' ' 81' ' ' LEU . . . -179.73 176.53 47.62 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.586 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.435 ' C ' HD11 ' A' ' 66' ' ' LEU . 14.6 m -112.42 175.32 5.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.829 0.347 . . . . 0.0 110.827 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.57 ' N ' HD11 ' A' ' 66' ' ' LEU . 46.7 t-80 -59.79 -32.04 70.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.852 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -78.77 -21.32 48.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.045 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.15 -49.69 6.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.833 0.349 . . . . 0.0 110.845 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.6 HD12 HD12 ' A' ' 66' ' ' LEU . 12.4 mt -82.4 -40.94 20.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.977 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.935 -179.964 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.93 HD12 ' HB2' ' A' ' 76' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.768 0.318 . . . . 0.0 110.895 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.45 152.53 21.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.029 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 7.7 tt -128.54 138.43 52.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.744 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.688 ' HB2' HG22 ' A' ' 77' ' ' ILE . 4.9 t30 -119.59 179.06 4.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.987 -179.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.454 HD11 ' NH2' ' A' ' 35' ' ' ARG . 0.6 OUTLIER -147.08 122.74 10.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.818 179.974 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.528 ' NZ ' HD13 ' A' ' 77' ' ' ILE . 8.4 mttp -103.17 169.3 8.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.871 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 7.0 tttt -65.83 -43.58 88.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.855 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.5 m -58.76 -29.88 67.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.974 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.551 ' HE1' HD13 ' A' ' 67' ' ' LEU . 38.7 t80 -77.14 -41.56 41.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.949 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -58.82 -45.13 90.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.866 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.476 ' O ' ' N ' ' A' ' 16' ' ' LYS . 2.7 mmmt -73.51 -45.06 56.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.026 0.441 . . . . 0.0 110.717 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.58 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -49.3 -25.76 2.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.982 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.617 ' CE1' HD22 ' A' ' 27' ' ' LEU . 75.9 t80 -91.49 -72.47 0.58 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.033 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.553 ' HA ' HD12 ' A' ' 18' ' ' LEU . 9.1 t70 -51.01 -45.3 61.16 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.357 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.476 ' N ' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -72.94 -13.5 61.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.36 -179.853 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.58 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 5.6 mt -90.34 -53.49 4.43 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 121.025 0.44 . . . . 0.0 110.356 179.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.553 HD12 ' HA ' ' A' ' 15' ' ' ASP . 0.5 OUTLIER -52.32 -33.87 44.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.219 -179.855 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.654 ' O ' HD12 ' A' ' 19' ' ' LEU . 4.3 pp -90.06 13.94 13.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.237 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -123.79 13.29 9.24 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.556 0.217 . . . . 0.0 111.406 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.41 29.16 5.77 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.787 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -110.73 118.13 35.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.888 0.375 . . . . 0.0 110.779 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.717 ' HB3' HG23 ' A' ' 26' ' ' VAL . 1.2 t70 -58.51 119.89 7.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.871 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.597 ' HA ' HD23 ' A' ' 27' ' ' LEU . 3.5 p-10 -66.17 -30.3 70.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.952 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 94.1 p -57.23 -27.51 62.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.153 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.717 HG23 ' HB3' ' A' ' 23' ' ' ASP . 31.4 t -71.96 -37.83 62.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.336 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.617 HD22 ' CE1' ' A' ' 14' ' ' PHE . 1.0 OUTLIER -59.76 -34.94 73.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.02 -179.819 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.533 ' O ' HD22 ' A' ' 32' ' ' LEU . 6.0 t-20 -61.25 -18.15 56.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.283 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.413 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 51.1 mt-10 -88.98 -35.76 16.22 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.78 0.324 . . . . 0.0 111.331 -179.759 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.916 HG13 HD12 ' A' ' 31' ' ' ILE . 15.0 p -90.69 -31.13 5.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.932 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.916 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -75.35 -47.98 32.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.658 -179.364 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.623 HD23 ' N ' ' A' ' 33' ' ' THR . 0.6 OUTLIER -56.34 -22.69 32.48 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.134 -179.539 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.623 ' N ' HD23 ' A' ' 32' ' ' LEU . 94.4 m -85.39 -27.39 25.84 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.673 0.273 . . . . 0.0 111.208 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.2 mt -84.64 -33.72 23.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.312 -179.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.454 ' NH2' HD11 ' A' ' 6' ' ' LEU . 1.0 OUTLIER -96.68 20.35 10.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.303 -179.89 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.542 ' O ' ' HG3' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -119.29 27.08 9.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.409 -179.768 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.542 ' HG3' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 35.6 36.14 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.67 -179.906 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -102.79 132.71 20.96 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.667 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -74.66 138.31 23.75 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.407 2.071 . . . . 0.0 112.524 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 6.0 mt -88.22 134.49 33.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.702 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -61.79 152.94 74.19 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.007 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.64 -8.25 23.18 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.532 2.155 . . . . 0.0 112.682 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.14 6.76 27.76 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.344 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -90.02 9.12 29.21 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.583 0.23 . . . . 0.0 111.316 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 36.2 mm-40 57.77 41.01 25.73 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.939 0.399 . . . . 0.0 111.057 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -87.54 86.56 7.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.984 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -139.84 -172.0 3.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.952 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.58 148.77 44.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.199 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.46 HD13 ' HB2' ' A' ' 56' ' ' PHE . 1.7 mp -84.74 177.68 7.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.875 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.18 156.76 22.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.89 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.95 -131.46 10.75 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.609 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.42 -13.92 50.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.56 0.219 . . . . 0.0 111.276 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 8.9 m95 -95.49 23.83 5.68 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.661 0.267 . . . . 0.0 111.291 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.463 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.4 OUTLIER -60.67 -49.16 90.95 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.047 179.988 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.463 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 36.9 Cg_exo -57.42 -16.85 24.73 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.449 2.099 . . . . 0.0 112.43 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.46 ' HB2' HD13 ' A' ' 49' ' ' LEU . 96.7 m-85 -93.3 176.31 6.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.867 0.365 . . . . 0.0 111.02 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.527 ' O ' HG13 ' A' ' 68' ' ' VAL . 22.2 ttm180 -132.29 137.88 47.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.899 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.406 ' HG3' HG22 ' A' ' 68' ' ' VAL . 3.8 tt0 -95.91 176.19 6.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.046 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 3.0 t -169.06 107.01 0.43 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.888 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.566 ' CE1' HD22 ' A' ' 66' ' ' LEU . 7.0 m170 -92.08 77.4 5.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.847 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.525 ' H ' HD12 ' A' ' 61' ' ' ILE . 4.3 mp -58.28 -28.97 36.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.061 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.402 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 1.3 mtpm? -139.06 169.47 12.38 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.875 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.402 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 11.3 Cg_exo -70.7 -2.47 10.9 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.77 2.313 . . . . 0.0 112.838 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -139.55 27.1 2.29 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.836 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.798 ' O ' HD23 ' A' ' 66' ' ' LEU . 46.2 t -140.13 149.97 21.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.016 0.436 . . . . 0.0 111.1 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.798 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.8 OUTLIER -148.6 91.46 1.89 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.608 179.87 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.739 HD12 ' N ' ' A' ' 68' ' ' VAL . 2.4 tp -91.42 122.76 34.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.962 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.739 ' N ' HD12 ' A' ' 67' ' ' LEU . 56.0 t -99.15 133.46 41.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.912 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.775 ' CD1' HD11 ' A' ' 76' ' ' LEU . 23.7 p90 -140.95 172.49 12.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.92 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.639 ' HB2' HD11 ' A' ' 77' ' ' ILE . 5.7 tp -118.5 136.12 54.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.872 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.515 HG22 ' N ' ' A' ' 72' ' ' LYS . 8.7 p -80.67 159.29 4.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.172 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.515 ' N ' HG22 ' A' ' 71' ' ' VAL . 0.0 OUTLIER -143.75 156.54 44.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.895 179.381 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -40.9 -32.3 0.22 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.837 -179.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -165.6 33.57 0.05 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.759 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -156.67 163.5 39.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.949 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.93 ' HB2' HD12 ' A' ' 2' ' ' LEU . 11.8 tp -125.9 139.62 53.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.712 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.688 HG22 ' HB2' ' A' ' 5' ' ' ASN . 1.8 pp -129.46 129.8 67.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.171 -179.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.542 HD13 ' CE2' ' A' ' 10' ' ' PHE . 66.8 mt -73.29 146.22 45.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.882 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.425 ' HG ' ' CD2' ' A' ' 56' ' ' PHE . 0.1 OUTLIER -112.98 -70.75 0.79 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.009 -179.891 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.87 157.48 37.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.041 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.581 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.4 tm? -111.49 133.7 53.59 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.032 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.581 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -136.99 -167.91 11.24 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.371 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.6 m -151.13 162.23 41.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.844 0.354 . . . . 0.0 110.795 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -55.75 -28.0 53.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.752 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 64.8 m -89.93 -27.43 19.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.826 179.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.06 -70.91 0.47 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.987 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.584 HD12 ' HB2' ' A' ' 66' ' ' LEU . 17.9 mt -68.81 -37.07 78.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.967 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.884 179.968 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.465 HD12 ' CB ' ' A' ' 76' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.774 0.321 . . . . 0.0 110.845 . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.63 150.51 32.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.973 -179.958 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.646 HD11 HD11 ' A' ' 78' ' ' LEU . 9.0 tt -119.33 148.08 43.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.833 179.945 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.743 ' HB2' HG22 ' A' ' 77' ' ' ILE . 4.9 t30 -135.14 -177.58 4.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.9 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.512 HD11 ' NH2' ' A' ' 35' ' ' ARG . 17.2 mt -146.73 133.6 20.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.975 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.4 mmmt -104.34 174.76 5.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.969 179.94 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.7 tttm -64.98 -33.11 75.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.951 -179.975 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 m -69.52 -46.62 66.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.972 179.96 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.612 ' CE1' HD13 ' A' ' 67' ' ' LEU . 23.5 t80 -59.74 -30.08 68.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.98 -179.994 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.0 mm-40 -60.42 -46.12 91.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.0 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.499 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 0.7 OUTLIER -73.85 -19.85 60.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.047 0.451 . . . . 0.0 111.174 -179.993 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.426 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 74.2 m-20 -90.46 -16.96 27.99 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.984 179.708 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.589 ' O ' HD13 ' A' ' 18' ' ' LEU . 20.4 t80 -90.99 -68.54 0.78 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.434 -179.506 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.801 ' HA ' HD22 ' A' ' 18' ' ' LEU . 38.8 t70 -91.01 -40.51 11.61 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -178.903 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.499 ' HB3' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -70.89 -24.8 62.55 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.35 -178.979 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.426 ' HB2' ' HA ' ' A' ' 13' ' ' ASP . 27.4 tp -72.54 -34.47 67.56 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 179.151 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.801 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.1 OUTLIER -57.63 -31.11 65.92 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.733 179.859 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 14.4 mt -89.97 -6.56 55.53 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.442 -179.984 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.68 28.3 3.48 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.732 0.301 . . . . 0.0 111.105 -179.861 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 92.89 23.05 26.43 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.814 179.804 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.502 ' CD1' HD12 ' A' ' 18' ' ' LEU . 11.1 t80 -113.79 135.44 53.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.857 0.361 . . . . 0.0 110.768 179.81 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.414 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 18.6 t0 -93.39 122.1 35.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.923 -179.98 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -58.3 -20.57 43.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.429 179.959 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 t -50.57 -55.42 16.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.732 0.301 . . . . 0.0 111.195 -179.88 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 37.9 t -67.2 -34.87 72.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.079 -179.952 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.839 ' CD1' HD13 ' A' ' 31' ' ' ILE . 5.4 tp -62.99 -29.93 71.2 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.715 179.949 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.581 ' O ' HD22 ' A' ' 32' ' ' LEU . 47.3 t30 -63.5 -22.88 67.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.212 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.481 ' HA ' HD22 ' A' ' 32' ' ' LEU . 3.6 mt-10 -87.07 -18.16 31.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.351 -179.896 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.708 HG13 HG21 ' A' ' 61' ' ' ILE . 66.3 t -90.26 -69.53 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.003 0.43 . . . . 0.0 111.613 -179.705 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.839 HD13 ' CD1' ' A' ' 27' ' ' LEU . 1.2 mp -48.42 -44.01 13.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.231 -178.975 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.583 HD23 ' N ' ' A' ' 33' ' ' THR . 0.4 OUTLIER -60.8 -15.94 35.4 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 121.079 -0.248 . . . . 0.0 111.568 -179.418 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.583 ' N ' HD23 ' A' ' 32' ' ' LEU . 85.7 m -90.08 -36.27 14.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.759 0.314 . . . . 0.0 111.025 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.9 mt -82.34 -29.61 30.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.331 -179.586 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.512 ' NH2' HD11 ' A' ' 6' ' ' LEU . 22.0 mtt180 -94.62 20.31 8.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.398 -179.76 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.474 ' O ' ' CG ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -126.68 26.76 6.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.068 -179.822 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.474 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 0.6 OUTLIER 47.33 53.67 10.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.178 -179.82 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -128.45 102.78 20.31 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.703 179.944 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -68.09 136.67 38.53 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.396 2.064 . . . . 0.0 112.341 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.625 HD13 ' SG ' ' A' ' 59' ' ' CYS . 1.2 mp -74.1 158.21 34.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.993 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.19 164.28 53.15 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.005 -179.909 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.53 -13.34 38.72 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.61 2.207 . . . . 0.0 112.487 179.941 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -86.89 7.49 27.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.421 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -93.53 14.17 19.61 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.109 179.941 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 58.76 38.69 24.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.91 0.386 . . . . 0.0 111.057 179.979 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.9 p-10 -83.62 79.74 9.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.892 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -137.43 176.11 9.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.94 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.69 152.45 37.51 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.143 -179.905 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.467 HD11 ' HG3' ' A' ' 58' ' ' GLU . 8.1 mt -97.15 -176.67 3.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.785 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -135.24 155.68 50.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.995 0.426 . . . . 0.0 110.899 -179.979 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 60.4 106.35 0.01 OUTLIER Glycine 0 CA--C 1.508 -0.387 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.704 179.951 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.53 -46.77 0.59 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.63 0.252 . . . . 0.0 111.074 179.939 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 62.3 m95 -99.63 33.33 2.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.823 0.344 . . . . 0.0 111.018 -179.881 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.44 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -71.63 -50.83 9.88 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.899 -179.948 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.44 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 14.1 Cg_exo -68.74 -7.08 19.55 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.639 2.226 . . . . 0.0 112.43 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.464 ' CD2' HD13 ' A' ' 70' ' ' LEU . 69.5 m-85 -102.2 178.3 4.64 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.949 0.404 . . . . 0.0 111.071 -179.785 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.627 ' O ' HG13 ' A' ' 68' ' ' VAL . 0.1 OUTLIER -137.47 144.64 42.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.726 -179.984 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.545 ' HG3' HG22 ' A' ' 68' ' ' VAL . 1.5 tt0 -107.18 168.57 9.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.998 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.625 ' SG ' HD13 ' A' ' 40' ' ' LEU . 15.0 t -168.33 123.8 0.98 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.896 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 9.1 m170 -93.28 93.17 8.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.97 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.708 HG21 HG13 ' A' ' 30' ' ' VAL . 4.4 mp -60.1 -31.56 48.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.861 179.895 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.442 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 6.1 mtpp -145.89 172.5 5.21 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.622 -179.932 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.442 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 17.4 Cg_exo -66.38 -4.29 10.39 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.672 2.248 . . . . 0.0 112.856 -179.888 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -142.02 29.07 1.68 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.861 179.792 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.518 ' C ' HD23 ' A' ' 66' ' ' LEU . 61.2 t -149.39 143.29 18.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.257 -180.0 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.789 HD12 HD13 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -159.13 118.71 3.03 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.683 179.961 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.612 HD13 ' CE1' ' A' ' 10' ' ' PHE . 0.2 OUTLIER -120.48 136.69 54.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.85 0.357 . . . . 0.0 110.968 -179.934 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.627 HG13 ' O ' ' A' ' 57' ' ' ARG . 57.1 t -91.53 137.13 22.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.894 -179.958 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -135.49 172.95 12.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.858 179.934 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.78 ' HB2' HD11 ' A' ' 77' ' ' ILE . 5.0 tp -117.23 162.23 18.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.905 -179.971 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.6 t -106.03 113.38 42.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.12 179.967 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -109.28 159.82 16.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.89 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -58.6 106.44 0.4 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.9 179.969 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.5 t70 57.4 26.59 12.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.101 -179.809 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -157.78 148.7 21.13 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.855 -179.988 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.465 ' CB ' HD12 ' A' ' 2' ' ' LEU . 7.6 tp -120.72 138.12 54.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.834 179.974 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.78 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.2 pp -124.84 135.61 63.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.198 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.646 HD11 HD11 ' A' ' 4' ' ' LEU . 58.4 mt -80.04 142.78 34.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.735 179.789 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.415 ' HG ' ' CD2' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -103.89 -71.69 0.72 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.06 -179.789 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.91 161.07 40.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.882 0.373 . . . . 0.0 111.349 -179.841 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.705 HD22 ' N ' ' A' ' 82' ' ' GLY . 1.7 tm? -123.73 133.44 53.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.635 179.911 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.705 ' N ' HD22 ' A' ' 81' ' ' LEU . . . -155.03 -176.95 27.82 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.572 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.7 t -121.5 172.31 8.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.803 0.335 . . . . 0.0 110.936 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -60.06 -28.41 67.77 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.873 179.988 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 49.3 p -82.86 -21.62 34.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.157 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.68 -66.81 0.86 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.809 0.338 . . . . 0.0 111.015 -179.827 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.789 HD13 HD12 ' A' ' 66' ' ' LEU . 6.7 mp -57.69 -37.15 72.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.084 -179.818 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.86 -179.934 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 6.6 mt . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.843 0.354 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.89 150.54 45.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.863 179.875 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.741 HD11 HD11 ' A' ' 78' ' ' LEU . 7.6 tt -119.51 150.16 40.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.971 179.957 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.768 ' HB2' HG22 ' A' ' 77' ' ' ILE . 2.9 t30 -136.47 170.38 16.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.918 179.989 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 39.4 mt -131.18 117.76 19.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.798 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -87.61 165.68 15.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.947 179.911 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.0 mttt -66.89 -40.12 87.67 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.83 -179.973 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.9 t -58.96 -35.77 73.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.965 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 39.7 t80 -61.42 -30.16 70.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.008 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -75.95 -33.98 59.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.92 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.434 ' O ' ' CB ' ' A' ' 16' ' ' LYS . 60.6 mttt -89.98 -14.16 34.6 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.199 179.853 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.456 ' O ' ' CB ' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -90.31 -21.18 22.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.971 0.415 . . . . 0.0 110.434 179.394 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.506 ' O ' HD12 ' A' ' 18' ' ' LEU . 40.8 t80 -91.4 -74.65 0.5 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.951 179.461 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.552 ' HA ' HD12 ' A' ' 18' ' ' LEU . 0.2 OUTLIER -51.07 -47.99 61.69 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.781 -179.967 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.442 ' HA ' HD21 ' A' ' 19' ' ' LEU . 1.6 tppt? -71.87 -13.3 61.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.69 -179.455 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.463 ' HG ' ' CB ' ' A' ' 22' ' ' PHE . 28.3 tp -90.64 -51.31 5.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.933 0.397 . . . . 0.0 110.348 179.837 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.552 HD12 ' HA ' ' A' ' 15' ' ' ASP . 0.4 OUTLIER -55.76 -34.63 65.38 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.344 -179.904 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.575 ' C ' HD12 ' A' ' 19' ' ' LEU . 4.0 pp -80.81 -10.7 59.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.224 179.874 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.12 23.14 6.79 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.732 0.301 . . . . 0.0 111.203 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.73 42.36 7.78 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.725 179.806 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.467 ' HB3' ' HA ' ' A' ' 18' ' ' LEU . 89.2 t80 -114.5 122.49 46.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.823 0.344 . . . . 0.0 110.879 179.814 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.475 ' HB3' HG23 ' A' ' 26' ' ' VAL . 1.1 t70 -61.32 103.39 0.3 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.838 -179.979 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.868 ' HA ' HD23 ' A' ' 27' ' ' LEU . 3.1 p30 -64.01 -24.42 67.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.128 -179.914 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.2 m -61.68 -47.52 84.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.236 -179.77 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.475 HG23 ' HB3' ' A' ' 23' ' ' ASP . 39.9 t -56.03 -43.89 76.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.313 -179.682 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.868 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.4 OUTLIER -59.83 -30.4 68.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.825 -179.963 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.679 ' O ' HD22 ' A' ' 32' ' ' LEU . 5.2 t-20 -53.45 -32.01 48.05 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.677 179.835 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.456 ' C ' HD22 ' A' ' 32' ' ' LEU . 1.7 mm-40 -75.71 -20.24 58.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.865 179.677 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.828 HG21 HG11 ' A' ' 65' ' ' VAL . 87.0 t -90.52 -74.0 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.761 -179.695 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.6 mp -44.11 -45.53 2.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.452 -178.985 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.821 HD23 ' N ' ' A' ' 33' ' ' THR . 0.4 OUTLIER -58.92 -16.69 18.91 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.864 -0.334 . . . . 0.0 111.531 -179.453 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.821 ' N ' HD23 ' A' ' 32' ' ' LEU . 65.2 m -90.0 -27.63 19.63 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 120.79 0.328 . . . . 0.0 110.785 179.689 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 30.1 mt -85.92 -33.42 21.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.241 -179.728 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.0 mtm180 -94.69 20.28 8.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.4 -179.74 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.442 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.1 OUTLIER -122.72 22.3 9.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.374 -179.867 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.434 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 0.6 OUTLIER 45.38 45.83 10.22 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.293 -179.946 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -117.46 127.97 26.32 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.798 -179.992 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.51 154.58 55.31 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.436 2.09 . . . . 0.0 112.257 -179.983 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.535 HD22 ' SG ' ' A' ' 59' ' ' CYS . 3.5 mp -102.46 146.32 28.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.92 179.972 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -66.79 158.58 79.48 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.922 179.918 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.51 -29.05 53.26 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.51 2.14 . . . . 0.0 112.18 179.949 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.36 -20.42 62.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.062 179.966 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.498 ' CE2' HD23 ' A' ' 40' ' ' LEU . 4.0 m-85 -61.3 -23.52 65.76 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.035 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 62.05 42.19 10.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.955 -179.991 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -75.54 84.08 2.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.845 179.932 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -134.02 -168.67 2.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.87 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -84.33 138.29 32.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.251 179.931 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.448 HD11 ' HB2' ' A' ' 58' ' ' GLU . 3.0 mp -76.75 -174.15 2.91 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.837 179.966 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.4 mttm -125.23 153.71 42.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.879 179.962 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 96.32 -113.71 4.74 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.644 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.1 -19.56 20.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.602 0.239 . . . . 0.0 111.15 -179.871 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.412 ' HB2' ' HB2' ' A' ' 49' ' ' LEU . 36.3 m95 -96.37 30.64 2.46 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.87 0.367 . . . . 0.0 110.945 -179.963 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.535 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 2.6 mtpt -69.48 -54.77 10.49 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.536 -179.874 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 21.7 Cg_endo -61.37 -10.42 15.89 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.293 1.995 . . . . 0.0 112.788 -179.799 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.611 ' CE1' HD21 ' A' ' 79' ' ' LEU . 47.4 m-85 -104.75 172.31 6.86 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.874 0.368 . . . . 0.0 110.918 179.818 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.419 ' O ' HG13 ' A' ' 68' ' ' VAL . 1.3 ttm180 -120.31 158.29 27.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.783 -179.813 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.448 ' HB2' HD11 ' A' ' 49' ' ' LEU . 6.8 tp10 -123.95 162.96 22.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.036 -179.92 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.535 ' SG ' HD22 ' A' ' 40' ' ' LEU . 1.1 t -154.97 112.24 3.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.754 179.933 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 9.1 m170 -86.02 71.16 10.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 -179.88 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.75 HD11 ' HB3' ' A' ' 67' ' ' LEU . 3.8 mp -59.08 -27.14 35.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.07 179.818 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.415 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 3.3 mttp -148.73 164.77 20.02 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.637 -179.804 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.415 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 42.0 Cg_endo -67.4 -3.22 9.65 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.447 2.098 . . . . 0.0 112.848 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -139.19 26.71 2.39 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.675 179.708 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.828 HG11 HG21 ' A' ' 30' ' ' VAL . 52.1 t -143.42 146.16 21.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.264 -179.909 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.807 HD12 HD12 ' A' ' 87' ' ' LEU . 1.7 mt -147.95 96.58 2.67 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.718 179.855 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.765 HD22 ' N ' ' A' ' 68' ' ' VAL . 1.4 tm? -84.51 134.87 34.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.01 -179.986 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.765 ' N ' HD22 ' A' ' 67' ' ' LEU . 94.7 t -106.83 119.83 57.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.399 179.261 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.735 ' CD2' HD11 ' A' ' 76' ' ' LEU . 13.6 p90 -136.13 178.32 7.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.062 -179.498 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.763 ' HB2' HD11 ' A' ' 77' ' ' ILE . 5.2 tp -130.29 168.5 16.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.914 179.977 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -120.47 110.01 27.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.117 -179.981 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.87 176.48 5.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.778 179.986 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -59.78 103.16 0.19 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.905 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 55.89 24.52 7.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.119 -179.855 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -149.61 153.56 37.26 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.91 -179.957 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.735 HD11 ' CD2' ' A' ' 69' ' ' TYR . 8.0 tt -123.88 144.14 49.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.684 179.853 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.768 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.5 pp -129.33 138.05 55.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.315 -179.788 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.741 HD11 HD11 ' A' ' 4' ' ' LEU . 89.6 mt -86.58 131.46 34.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.553 179.625 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.611 HD21 ' CE1' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -91.78 -74.17 0.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.104 -179.607 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.619 ' NH1' HD21 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -155.75 177.68 11.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.874 0.369 . . . . 0.0 111.345 -179.845 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.766 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.5 tm? -119.2 134.76 55.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.93 -179.885 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.766 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -140.61 -173.18 13.3 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.538 179.961 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.9 m -144.58 171.07 14.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.867 0.365 . . . . 0.0 110.99 -179.968 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -59.68 -28.45 67.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.95 179.91 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.2 m -87.83 -26.31 22.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.087 -179.985 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -80.67 -70.21 0.54 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.912 -179.932 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.807 HD12 HD12 ' A' ' 66' ' ' LEU . 1.0 OUTLIER -70.25 -38.29 75.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.01 -179.908 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.919 179.984 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.5 mt . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.836 0.35 . . . . 0.0 111.015 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.12 150.72 28.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.851 179.927 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.547 HD11 HD11 ' A' ' 78' ' ' LEU . 1.7 tt -116.06 147.5 41.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.916 179.996 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.819 ' HB2' HG22 ' A' ' 77' ' ' ILE . 2.3 t30 -133.9 -178.39 5.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.943 179.945 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.3 mt -142.82 112.14 6.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.874 -179.93 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.2 mmtp -85.61 161.63 19.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.88 -179.997 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 17.4 mmtm -62.06 -30.85 71.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.951 179.969 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.0 t -72.15 -33.27 67.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.98 179.929 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.739 ' HE1' HD13 ' A' ' 67' ' ' LEU . 43.6 t80 -73.97 -31.1 62.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.904 -179.936 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -65.39 -40.72 93.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.929 179.977 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 17.5 mttt -88.63 -11.17 46.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.317 179.962 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.407 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 1.2 m-20 -90.44 -26.21 19.96 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.828 0.347 . . . . 0.0 110.415 179.516 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.791 ' O ' HD13 ' A' ' 18' ' ' LEU . 66.4 t80 -91.09 -70.71 0.67 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.177 179.866 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.702 ' HA ' HD22 ' A' ' 18' ' ' LEU . 4.2 t0 -62.6 -52.47 63.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.833 -179.197 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -62.41 -17.68 59.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.62 -179.279 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.407 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 44.9 tp -90.23 -40.94 11.87 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.075 0.464 . . . . 0.0 110.34 179.566 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.791 HD13 ' O ' ' A' ' 14' ' ' PHE . 0.0 OUTLIER -48.86 -45.26 40.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.192 -179.705 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.1 mt -90.06 0.79 56.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.802 -179.482 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -97.92 30.79 2.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.853 0.359 . . . . 0.0 111.003 -179.984 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 92.38 22.86 28.19 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.685 179.929 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.585 ' CD1' HD12 ' A' ' 18' ' ' LEU . 30.2 t80 -110.08 127.06 54.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.843 0.354 . . . . 0.0 110.704 179.845 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.575 ' HB3' HG23 ' A' ' 26' ' ' VAL . 4.9 t0 -68.09 110.35 3.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.888 -179.979 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.547 ' HA ' HD23 ' A' ' 27' ' ' LEU . 11.4 p-10 -61.71 -19.46 62.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.222 179.836 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.66 -20.91 66.09 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.273 179.987 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.575 HG23 ' HB3' ' A' ' 23' ' ' ASP . 21.8 t -82.1 -40.2 17.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.426 -179.752 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.609 HD13 ' CZ ' ' A' ' 14' ' ' PHE . 1.2 pp -56.6 -36.56 69.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.965 -179.777 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.732 ' O ' HD22 ' A' ' 32' ' ' LEU . 11.6 t30 -63.23 -16.2 59.47 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.408 -179.97 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.418 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 57.2 mt-10 -90.12 -35.27 15.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.837 0.351 . . . . 0.0 111.218 -179.716 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 1.051 HG23 HG21 ' A' ' 61' ' ' ILE . 11.8 p -90.5 -32.2 5.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.367 -0.379 . . . . 0.0 112.002 -179.589 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.926 HD12 HG13 ' A' ' 30' ' ' VAL . 1.7 mp -76.49 -48.86 25.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.578 -179.446 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.732 HD22 ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -56.96 -22.43 37.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.683 0.278 . . . . 0.0 111.189 -179.752 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.724 ' N ' HD23 ' A' ' 32' ' ' LEU . 93.5 m -82.68 -28.93 30.29 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.878 0.371 . . . . 0.0 110.808 179.66 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.725 HD21 HD21 ' A' ' 40' ' ' LEU . 12.6 mt -90.12 -23.04 21.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.731 -179.421 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -104.16 20.24 18.67 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -179.176 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.466 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 7.4 mtmt -118.37 -55.85 2.19 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.211 179.79 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.466 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 10.1 pttm 156.29 -20.54 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.035 179.665 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -61.86 111.27 4.2 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.072 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -68.64 163.86 35.35 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.412 2.075 . . . . 0.0 112.117 179.8 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.725 HD21 HD21 ' A' ' 34' ' ' LEU . 5.2 mt -86.44 123.42 31.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.064 179.977 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -61.6 157.26 48.74 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.947 -179.871 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.77 -30.56 49.89 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.616 2.21 . . . . 0.0 112.294 179.875 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.79 -19.47 59.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.01 179.822 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.439 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.1 m-85 -62.69 -16.52 57.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.217 179.983 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 67.44 52.06 0.82 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.923 0.392 . . . . 0.0 110.952 -179.862 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.6 p-10 -88.28 107.69 18.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.787 179.902 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.96 -168.29 3.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.855 -179.965 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -90.8 126.89 36.15 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.143 179.855 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.489 HD21 ' CD ' ' A' ' 58' ' ' GLU . 1.5 mp -64.48 169.01 5.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.895 179.93 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.42 167.75 10.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.09 179.948 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.27 -126.3 7.32 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.559 -179.94 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.03 -5.22 55.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.639 0.257 . . . . 0.0 111.37 179.965 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 6.0 m0 -97.65 29.31 3.39 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.89 0.376 . . . . 0.0 110.966 179.949 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.527 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -66.83 -56.2 14.9 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.407 -179.871 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 19.0 Cg_endo -59.2 -12.65 16.74 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.343 2.029 . . . . 0.0 112.572 -179.994 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.457 ' CD1' HD21 ' A' ' 79' ' ' LEU . 17.7 m-85 -93.71 170.12 9.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.841 0.353 . . . . 0.0 110.865 179.949 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.78 132.95 44.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.793 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.516 ' HG3' HG22 ' A' ' 68' ' ' VAL . 1.8 tt0 -104.76 170.01 8.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.971 -179.961 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.41 ' SG ' HD13 ' A' ' 40' ' ' LEU . 16.3 t -164.94 122.45 1.6 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.764 -179.981 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 10.4 m170 -93.02 84.22 4.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.068 -179.826 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 1.051 HG21 HG23 ' A' ' 30' ' ' VAL . 3.6 mp -64.82 -49.58 79.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.041 0.448 . . . . 0.0 110.811 179.714 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.617 ' HD2' HG22 ' A' ' 61' ' ' ILE . 0.1 OUTLIER -111.03 174.11 2.52 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.476 -179.851 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.412 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 12.9 Cg_exo -69.1 -5.82 16.74 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.617 2.211 . . . . 0.0 112.78 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -150.19 34.18 0.65 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.782 179.941 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.861 ' O ' HD23 ' A' ' 66' ' ' LEU . 88.5 t -133.7 142.68 40.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.94 -179.835 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.861 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.6 OUTLIER -145.97 98.81 3.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.876 179.97 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.739 HD13 ' HE1' ' A' ' 10' ' ' PHE . 1.0 OUTLIER -97.65 113.39 25.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.552 179.983 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.529 ' N ' HD12 ' A' ' 67' ' ' LEU . 60.9 t -85.24 138.07 19.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.255 -179.835 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 31.4 p90 -143.8 147.14 33.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.863 179.781 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.803 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.3 OUTLIER -103.28 157.36 17.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.871 -179.892 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.682 ' H ' HD23 ' A' ' 70' ' ' LEU . 21.6 t -107.81 109.92 30.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.25 -179.929 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.66 165.97 19.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.623 179.8 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -41.88 -32.73 0.44 Allowed 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.378 -179.811 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -163.43 29.9 0.09 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.805 179.757 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -150.0 162.02 41.19 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.7 -179.864 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.2 tp -117.13 137.23 52.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.93 0.395 . . . . 0.0 110.66 179.706 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.819 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.4 pp -128.16 137.75 56.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.245 -179.849 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.547 HD11 HD11 ' A' ' 4' ' ' LEU . 80.0 mt -84.24 119.93 25.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.738 179.788 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.497 HD13 HG12 ' A' ' 68' ' ' VAL . 0.2 OUTLIER -78.32 -68.86 0.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.901 -179.925 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.466 ' HD3' ' HB3' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -163.04 170.26 18.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.917 0.389 . . . . 0.0 111.355 179.826 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.755 HD21 HG13 ' A' ' 65' ' ' VAL . 3.4 tm? -126.91 134.19 50.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.662 179.96 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.565 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -160.39 -168.83 22.87 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.554 179.985 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.1 m -123.85 178.12 5.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.914 0.388 . . . . 0.0 110.732 -179.93 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -60.7 -29.3 69.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.001 -179.857 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.1 t -85.62 -30.43 23.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.035 -179.882 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.53 -71.68 0.4 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.898 -179.827 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.44 HD13 ' HB2' ' A' ' 66' ' ' LEU . 1.0 OUTLIER -63.4 -33.36 75.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.867 179.999 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.811 -179.96 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.2 mt . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.764 0.316 . . . . 0.0 110.904 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.83 165.61 3.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.818 179.969 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.6 tt -133.95 153.8 51.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.996 -179.919 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.765 ' HB2' HG22 ' A' ' 77' ' ' ILE . 7.0 t30 -138.19 -178.11 5.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.806 -179.993 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.612 HD23 HD12 ' A' ' 78' ' ' LEU . 15.4 mt -146.14 133.37 20.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.976 -179.956 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.82 164.34 11.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.796 179.968 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.4 -31.73 72.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.93 -179.96 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.6 p -70.29 -37.31 74.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.92 179.988 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -59.2 -49.74 76.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.894 -179.948 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -64.03 -44.36 92.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.916 -179.995 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.0 mmtt -74.37 -7.67 53.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.526 179.968 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.28 -31.76 16.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.767 0.317 . . . . 0.0 110.962 -179.913 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.753 ' HE2' HD13 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -90.21 -54.9 3.82 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.344 179.944 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -49.46 -32.37 11.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.769 179.474 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.57 -22.35 26.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.86 179.62 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.417 ' O ' ' HB3' ' A' ' 22' ' ' PHE . 2.6 mt -83.77 -49.54 8.99 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 120.943 0.401 . . . . 0.0 110.264 179.682 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.803 HD13 ' HD1' ' A' ' 22' ' ' PHE . 4.3 mm? -47.26 -40.51 16.74 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.398 179.957 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.5 mt -89.54 -0.49 57.54 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.899 -179.405 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -98.52 33.49 2.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.804 0.335 . . . . 0.0 110.782 -179.887 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.66 23.53 53.04 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.331 -179.924 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.803 ' HD1' HD13 ' A' ' 18' ' ' LEU . 26.4 t80 -107.1 115.84 30.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.809 0.338 . . . . 0.0 110.675 -179.868 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.413 ' O ' ' CD1' ' A' ' 22' ' ' PHE . 5.9 t70 -55.1 146.25 18.85 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.193 -179.742 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.522 ' HA ' HD23 ' A' ' 27' ' ' LEU . 3.3 p30 -96.52 -29.22 14.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.048 -179.988 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.1 m -57.62 -40.61 79.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.112 -179.861 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.404 HG12 ' HB3' ' A' ' 23' ' ' ASP . 12.2 p -74.62 -26.85 20.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.332 -179.999 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.753 HD13 ' HE2' ' A' ' 14' ' ' PHE . 0.3 OUTLIER -59.71 -39.98 86.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.829 0.347 . . . . 0.0 110.901 -179.957 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.472 ' O ' ' HB3' ' A' ' 32' ' ' LEU . 32.1 t-20 -50.27 -57.62 7.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.025 -179.759 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.566 ' HA ' HD22 ' A' ' 32' ' ' LEU . 28.8 mt-10 -51.77 -19.83 1.85 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.744 179.952 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.457 HG22 ' HG3' ' A' ' 62' ' ' LYS . 76.6 t -88.94 -74.36 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.836 0.351 . . . . 0.0 111.746 -179.452 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.7 mp -50.77 -45.39 27.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.15 -0.477 . . . . 0.0 112.011 -178.982 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.891 HD23 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -57.05 -34.61 68.41 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 121.001 -0.28 . . . . 0.0 111.061 -179.498 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.891 ' N ' HD23 ' A' ' 32' ' ' LEU . 90.2 m -68.68 -27.11 65.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.796 0.331 . . . . 0.0 110.875 179.88 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 46.7 mt -90.06 -25.73 20.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.414 -179.719 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 20.4 mtp180 -104.17 20.12 18.9 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.278 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.507 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -115.62 -55.85 2.4 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.168 179.886 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.507 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 151.15 -20.43 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.996 0.518 . . . . 0.0 110.882 179.74 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.39 120.6 41.44 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.085 -179.638 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -72.49 -179.34 4.0 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.342 2.028 . . . . 0.0 112.135 179.882 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -123.2 129.28 51.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.84 179.958 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.414 ' HB2' ' CE1' ' A' ' 44' ' ' PHE . 1.9 m-20 -57.41 159.26 9.12 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.115 -179.887 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.75 -10.06 27.0 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.552 2.168 . . . . 0.0 112.471 -179.98 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.33 9.47 23.17 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.339 179.857 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.414 ' CE1' ' HB2' ' A' ' 41' ' ' ASP . 4.1 m-85 -89.43 8.42 30.94 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.292 179.864 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.426 ' HB2' ' CD2' ' A' ' 60' ' ' HIS . 1.2 mp0 60.31 40.0 18.2 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.824 0.345 . . . . 0.0 110.9 179.882 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -82.06 73.08 9.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.844 179.963 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -129.49 172.35 11.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.857 179.947 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -81.62 133.7 35.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.071 -179.946 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.627 HD11 ' HG3' ' A' ' 58' ' ' GLU . 15.4 mt -82.37 176.14 9.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.857 -179.993 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.7 mtpt -114.29 175.66 5.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.924 179.968 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.38 -128.78 13.71 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.5 -179.929 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.1 mmtt -67.98 -26.39 65.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.591 0.234 . . . . 0.0 110.889 179.995 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 5.6 m-90 -97.59 39.38 1.21 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.832 0.349 . . . . 0.0 110.887 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.461 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -75.35 -51.04 3.45 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.205 179.971 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 71.9 Cg_endo -77.73 3.52 6.84 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.32 2.013 . . . . 0.0 112.671 -179.988 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.418 ' HB3' ' CG1' ' A' ' 68' ' ' VAL . 12.4 m-85 -114.21 169.31 9.12 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.796 0.331 . . . . 0.0 110.89 179.904 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.41 ' HG2' ' CZ ' ' A' ' 69' ' ' TYR . 1.0 OUTLIER -128.58 145.22 51.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.947 -179.987 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.627 ' HG3' HD11 ' A' ' 49' ' ' LEU . 1.4 tt0 -102.75 165.78 10.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.909 179.946 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -162.31 116.72 1.83 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.855 179.938 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.426 ' CD2' ' HB2' ' A' ' 45' ' ' GLN . 5.0 m170 -90.68 85.88 6.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.986 179.978 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.587 ' H ' HD12 ' A' ' 61' ' ' ILE . 4.3 mp -59.8 -29.17 42.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.021 -179.978 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.457 ' HG3' HG22 ' A' ' 30' ' ' VAL . 4.7 mtpt -142.61 168.34 13.61 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.77 -179.911 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.403 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 20.3 Cg_exo -65.43 -6.71 14.09 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.643 2.229 . . . . 0.0 112.743 -179.916 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -138.64 25.95 2.57 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.86 179.789 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.402 ' O ' HD23 ' A' ' 66' ' ' LEU . 67.5 t -140.78 140.83 32.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.218 179.945 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 1.082 HD12 HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -157.31 114.86 3.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.485 179.974 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.662 HD12 ' O ' ' A' ' 68' ' ' VAL . 0.2 OUTLIER -121.23 139.43 53.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.039 -179.881 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.662 ' O ' HD12 ' A' ' 67' ' ' LEU . 39.2 t -88.69 147.0 5.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.794 179.841 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.41 ' CZ ' ' HG2' ' A' ' 57' ' ' ARG . 9.0 p90 -148.99 161.08 42.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.115 -179.974 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.802 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.3 OUTLIER -116.06 156.69 25.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.828 179.958 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.659 ' H ' HD23 ' A' ' 70' ' ' LEU . 21.3 t -107.33 99.75 9.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.184 179.951 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.76 170.72 13.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.781 179.947 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -60.43 104.25 0.31 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.809 179.945 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 57.17 20.98 6.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.139 -179.843 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -149.55 138.51 21.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.639 -179.982 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.37 148.33 24.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.867 179.699 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.802 HD11 ' HB2' ' A' ' 70' ' ' LEU . 1.9 pp -139.32 130.8 34.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.331 -179.87 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.612 HD12 HD23 ' A' ' 6' ' ' LEU . 80.0 mt -74.96 148.21 40.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.511 179.677 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.38 -73.58 0.68 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.273 -179.698 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.02 161.52 42.18 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.989 0.423 . . . . 0.0 111.499 -179.8 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.581 ' C ' HD13 ' A' ' 81' ' ' LEU . 3.4 tm? -115.01 131.56 56.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.694 179.881 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.581 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -137.17 -177.75 15.32 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.451 179.931 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.7 m -150.72 178.14 9.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.879 0.371 . . . . 0.0 110.893 179.995 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.0 t-80 -64.04 -27.17 68.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.948 -179.998 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.7 m -87.41 -28.26 22.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.945 179.94 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -85.62 -74.82 0.39 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.015 -179.895 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 1.082 HD12 HD12 ' A' ' 66' ' ' LEU . 41.3 mt -62.08 -41.74 98.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.956 -179.909 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.887 179.982 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 40.1 mt . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.845 0.355 . . . . 0.0 110.885 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.34 149.17 22.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.884 179.915 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.408 HD11 HD11 ' A' ' 78' ' ' LEU . 0.6 OUTLIER -115.66 148.15 40.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.956 179.912 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.78 ' HB2' HG22 ' A' ' 77' ' ' ILE . 5.6 t30 -133.46 176.75 8.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.824 179.948 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 54.1 mt -148.98 112.8 5.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.928 179.933 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.3 mmtt -86.89 176.87 7.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.935 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.06 -33.57 68.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.845 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.4 t -67.23 -35.9 80.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.949 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.644 ' HE2' HD13 ' A' ' 67' ' ' LEU . 22.2 t80 -72.06 -31.15 65.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.877 179.933 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -68.99 -40.45 78.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.843 179.976 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.402 ' O ' ' CB ' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -85.73 -9.49 57.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.336 -179.999 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.65 ' O ' HD12 ' A' ' 17' ' ' LEU . 0.7 OUTLIER -90.36 -27.18 19.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.714 0.292 . . . . 0.0 111.008 179.915 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.512 ' CE1' HD21 ' A' ' 18' ' ' LEU . 7.4 t80 -91.23 -69.52 0.73 Allowed 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.334 179.704 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.528 ' HA ' HD12 ' A' ' 18' ' ' LEU . 21.1 t0 -49.19 -50.08 39.69 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.239 179.719 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.402 ' CB ' ' O ' ' A' ' 12' ' ' LYS . 1.5 tpmp? -68.08 -13.52 62.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.205 -179.982 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.65 HD12 ' O ' ' A' ' 13' ' ' ASP . 3.9 mt -90.27 -55.09 3.74 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-O 121.189 0.518 . . . . 0.0 110.013 179.503 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.528 HD12 ' HA ' ' A' ' 15' ' ' ASP . 0.5 OUTLIER -54.57 -25.89 28.99 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.379 179.868 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 74.9 mt -90.08 -35.15 15.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.941 179.954 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -62.56 -23.36 66.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.146 -179.968 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.99 42.62 0.16 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.47 -179.946 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -113.44 123.54 50.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.777 0.323 . . . . 0.0 110.724 179.908 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.649 ' HB3' HG23 ' A' ' 26' ' ' VAL . 2.7 t0 -56.38 103.27 0.1 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.897 179.944 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.462 ' CA ' HD23 ' A' ' 27' ' ' LEU . 5.1 p30 -54.93 -28.71 53.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.026 -179.962 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.13 -27.05 52.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.095 -179.959 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.649 HG23 ' HB3' ' A' ' 23' ' ' ASP . 35.2 t -72.51 -35.74 52.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.261 -179.88 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.497 ' HB2' HD13 ' A' ' 31' ' ' ILE . 1.2 pp -58.54 -36.66 74.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.186 -179.625 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.848 ' O ' HD22 ' A' ' 32' ' ' LEU . 0.9 OUTLIER -58.42 -19.63 37.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.319 -179.798 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -90.06 -37.69 14.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.388 -179.624 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.833 HG13 HD12 ' A' ' 31' ' ' ILE . 14.8 p -90.31 -44.99 14.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 112.162 0.431 . . . . 0.0 112.162 -179.197 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.833 HD12 HG13 ' A' ' 30' ' ' VAL . 1.7 mp -62.25 -51.94 66.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.55 0.214 . . . . 0.0 111.408 -179.506 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.848 HD22 ' O ' ' A' ' 28' ' ' ASN . 0.4 OUTLIER -53.9 -37.24 63.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.716 0.293 . . . . 0.0 111.081 -179.576 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.722 ' H ' HD23 ' A' ' 32' ' ' LEU . 84.8 m -65.88 -37.65 86.71 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.866 0.365 . . . . 0.0 110.598 179.867 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.406 HD11 ' CD2' ' A' ' 67' ' ' LEU . 97.2 mt -72.82 -30.01 63.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.841 179.924 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.4 mtp180 -102.95 20.13 18.11 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.997 -179.983 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.441 ' O ' ' CG ' ' A' ' 37' ' ' LYS . 2.5 mmmt -116.85 19.38 14.43 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.369 -179.899 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.441 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 3.9 pttp 45.77 39.2 4.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.263 -179.957 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -108.07 111.91 61.78 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.731 -179.922 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -67.3 136.87 41.67 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.419 2.079 . . . . 0.0 112.257 179.961 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.479 HD13 ' SG ' ' A' ' 59' ' ' CYS . 27.0 mt -79.45 179.8 7.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.877 179.984 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -112.23 155.71 43.12 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.932 -179.988 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -67.17 -10.93 30.32 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 122.629 2.219 . . . . 0.0 112.537 179.92 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.96 7.23 25.14 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.417 179.937 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -93.47 14.95 17.08 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.585 0.231 . . . . 0.0 111.121 179.89 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 59.25 38.17 23.43 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.868 0.366 . . . . 0.0 110.972 179.89 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -93.55 112.72 24.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.927 179.945 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 24.8 p-80 -163.36 -175.74 4.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.899 -179.981 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.38 129.58 35.0 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.113 179.97 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.424 ' H ' HD12 ' A' ' 49' ' ' LEU . 4.4 mp -74.39 174.63 8.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.829 -179.929 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -102.63 163.58 12.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.895 -179.915 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.25 -137.51 18.51 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.602 -179.92 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.56 -5.07 48.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.649 0.261 . . . . 0.0 111.45 179.965 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 9.5 m0 -97.05 33.2 1.97 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.791 0.329 . . . . 0.0 111.096 -179.955 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.438 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 7.2 tttt -81.44 -51.05 0.89 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.962 179.957 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.448 ' O ' HD11 ' A' ' 70' ' ' LEU . 50.2 Cg_exo -55.46 -18.12 18.59 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.425 2.084 . . . . 0.0 112.367 179.749 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -102.1 177.86 4.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.904 0.383 . . . . 0.0 111.012 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.545 ' O ' HG13 ' A' ' 68' ' ' VAL . 5.7 tpp180 -135.96 139.63 43.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.936 179.984 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.404 ' HB2' HD11 ' A' ' 49' ' ' LEU . 4.6 tt0 -95.95 158.68 15.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.815 179.955 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.479 ' SG ' HD13 ' A' ' 40' ' ' LEU . 2.6 t -160.94 113.41 1.93 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.866 -179.945 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.423 ' ND1' HD22 ' A' ' 66' ' ' LEU . 3.5 m-70 -97.2 89.46 4.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.981 179.928 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.648 HD11 HD23 ' A' ' 67' ' ' LEU . 4.4 mp -55.08 -27.49 19.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.013 179.762 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.441 ' HB2' ' CD ' ' A' ' 63' ' ' PRO . 0.0 OUTLIER -154.77 170.96 7.76 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.551 179.971 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.441 ' CD ' ' HB2' ' A' ' 62' ' ' LYS . 17.0 Cg_exo -67.0 -0.06 4.33 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.689 2.259 . . . . 0.0 113.164 -179.702 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -134.86 25.21 3.64 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.664 0.268 . . . . 0.0 111.157 179.89 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.616 HG13 HD21 ' A' ' 81' ' ' LEU . 58.4 t -155.63 143.63 12.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.004 0.431 . . . . 0.0 111.309 179.913 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.825 HD12 HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -159.13 100.43 1.54 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.693 179.794 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.648 HD23 HD11 ' A' ' 61' ' ' ILE . 0.3 OUTLIER -105.84 151.51 24.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.893 -179.858 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.545 HG13 ' O ' ' A' ' 57' ' ' ARG . 59.0 t -100.53 139.95 20.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.13 -179.914 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.672 ' CD1' HD11 ' A' ' 76' ' ' LEU . 16.9 p90 -145.66 158.48 43.84 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.924 179.912 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.623 ' HB2' HD11 ' A' ' 77' ' ' ILE . 6.7 tp -114.08 157.77 22.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.857 179.866 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -113.75 105.34 18.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.206 -179.919 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 10.6 tptt -76.09 165.73 24.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.666 179.815 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -44.53 -31.87 1.24 Allowed 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.363 -179.942 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -160.4 28.79 0.16 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.787 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -148.55 163.51 36.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.654 179.985 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.672 HD11 ' CD1' ' A' ' 69' ' ' TYR . 10.0 tp -122.52 130.9 53.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.673 179.658 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.78 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.1 pp -122.8 133.35 69.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.349 -179.665 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.408 HD11 HD11 ' A' ' 4' ' ' LEU . 85.7 mt -82.25 126.61 32.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.637 179.648 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.38 -66.21 0.92 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.055 -179.783 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.52 ' HE ' HG21 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -162.13 165.71 26.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.989 0.423 . . . . 0.0 111.478 -179.945 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.702 HD22 ' N ' ' A' ' 82' ' ' GLY . 1.7 tm? -124.7 135.65 53.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.656 -179.913 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.702 ' N ' HD22 ' A' ' 81' ' ' LEU . . . -162.3 -172.19 29.42 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.687 179.932 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.92 -167.97 1.96 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.837 0.351 . . . . 0.0 110.878 -179.915 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -73.54 -27.53 61.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.022 -179.964 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.5 t -86.56 -22.69 26.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.221 -180.0 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -87.28 -69.13 0.7 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.853 0.359 . . . . 0.0 111.041 -179.987 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.825 HD12 HD12 ' A' ' 66' ' ' LEU . 25.4 mt -59.83 -40.68 89.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.025 -179.959 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.892 179.971 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 62.1 mt . . . . . 0 N--CA 1.457 -0.107 0 CA-C-O 120.736 0.303 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.69 156.11 17.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.918 179.997 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.442 HD11 HD11 ' A' ' 78' ' ' LEU . 2.2 tt -120.28 143.75 48.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.842 179.939 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.457 ' HB2' HG22 ' A' ' 77' ' ' ILE . 1.5 t-20 -126.7 178.5 5.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.985 -179.929 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 41.0 mt -144.18 123.12 12.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.899 179.965 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.3 mmmt -97.05 174.42 6.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.978 -179.924 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.06 -46.53 80.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.802 179.911 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 t -58.06 -24.11 57.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.934 179.831 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.742 ' HE1' HD13 ' A' ' 67' ' ' LEU . 32.9 t80 -84.23 -26.59 28.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.034 179.976 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -69.51 -28.03 65.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.204 -179.782 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.477 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -90.04 -7.47 53.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.781 -179.745 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.502 ' OD2' ' HA ' ' A' ' 10' ' ' PHE . 18.4 p30 -90.6 -15.97 29.57 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.894 0.378 . . . . 0.0 111.57 -179.811 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.649 ' O ' HD13 ' A' ' 18' ' ' LEU . 8.8 t80 -90.86 -60.21 1.97 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.228 -178.994 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.789 ' HA ' HD22 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -91.6 -41.0 11.01 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.374 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.477 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 2.0 mptm? -69.99 -40.08 75.53 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -178.839 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.407 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 0.9 OUTLIER -59.39 -29.39 67.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.929 0.395 . . . . 0.0 110.214 179.698 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.789 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.3 OUTLIER -62.47 -24.1 67.27 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.116 179.856 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.2 15.11 10.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.393 -179.885 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -123.87 45.0 2.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.818 0.342 . . . . 0.0 110.885 179.873 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 71.21 28.89 69.32 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.328 -179.946 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.468 ' CD1' HD12 ' A' ' 18' ' ' LEU . 8.9 t80 -113.18 140.58 47.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.854 0.359 . . . . 0.0 110.783 -179.93 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.419 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 4.3 t0 -97.49 117.9 32.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.902 179.987 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.821 ' HA ' HD23 ' A' ' 27' ' ' LEU . 2.9 p30 -59.73 -28.73 67.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.237 -179.923 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 25.1 p -54.96 -23.31 18.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.542 -179.83 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.6 t -87.38 -42.71 15.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.765 0.317 . . . . 0.0 111.384 -179.726 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.821 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.4 OUTLIER -59.25 -32.27 69.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.01 -179.833 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -53.51 -31.2 45.07 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.875 -179.986 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -81.63 -23.35 37.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.824 179.696 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 96.2 t -78.08 -73.1 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.023 -179.973 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.6 mp -47.45 -33.57 3.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.865 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.844 HD23 ' N ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -58.86 -55.18 38.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.565 179.72 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.844 ' N ' HD23 ' A' ' 32' ' ' LEU . 99.2 m -58.53 -34.76 71.35 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.945 -179.943 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.0 mt -66.75 -46.79 74.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.841 -179.978 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -96.04 20.15 10.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.084 179.994 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.8 mmtt -97.37 12.67 32.33 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.398 -179.905 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.4 mtmt 61.94 27.42 16.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.778 0.323 . . . . 0.0 110.832 179.964 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.25 123.72 29.17 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.863 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -74.31 150.22 41.44 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.361 2.04 . . . . 0.0 112.379 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.416 HD13 ' SG ' ' A' ' 59' ' ' CYS . 4.8 mt -88.27 128.05 35.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.818 179.996 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.26 158.22 88.07 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.066 -179.953 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.66 -10.33 28.36 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.526 2.15 . . . . 0.0 112.455 179.857 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.1 5.86 27.97 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.316 179.817 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -93.69 17.28 12.12 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-O 120.662 0.267 . . . . 0.0 111.183 179.872 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.421 ' HB2' ' CG ' ' A' ' 60' ' ' HIS . 45.0 mm-40 63.98 30.29 14.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.087 179.882 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -88.68 87.92 7.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.906 -179.962 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 17.8 p-80 -143.45 176.37 9.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.873 179.992 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.26 140.29 46.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.101 -179.959 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.572 HD21 ' OE1' ' A' ' 58' ' ' GLU . 1.4 mt -89.7 174.17 7.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.946 179.884 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.0 mtpm? -109.34 164.6 12.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.946 179.981 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.76 -140.91 22.18 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.513 179.989 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.2 tmtt? -74.02 -8.53 56.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.598 0.237 . . . . 0.0 111.352 -179.974 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 19.7 m-90 -96.51 26.39 4.45 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.762 0.315 . . . . 0.0 111.197 -179.942 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.461 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.2 OUTLIER -74.54 -49.52 4.92 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.002 179.911 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.461 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 43.6 Cg_exo -56.45 -17.65 22.37 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.4 2.067 . . . . 0.0 112.437 179.779 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -110.27 174.45 5.86 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.004 -179.87 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.458 ' O ' HG13 ' A' ' 68' ' ' VAL . 41.5 ttm180 -131.13 154.52 48.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.813 179.923 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.572 ' OE1' HD21 ' A' ' 49' ' ' LEU . 3.4 tt0 -105.03 170.14 8.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.931 -179.928 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.416 ' SG ' HD13 ' A' ' 40' ' ' LEU . 3.5 t -168.5 116.88 0.7 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.738 179.997 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.609 ' CD2' HD22 ' A' ' 66' ' ' LEU . 11.1 m170 -95.32 89.08 5.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.993 -179.938 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.582 ' H ' HD12 ' A' ' 61' ' ' ILE . 4.2 mp -66.25 -29.88 48.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.903 179.778 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 16.8 mttt -136.68 171.79 8.08 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.78 179.966 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -68.18 -3.12 10.14 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.663 2.242 . . . . 0.0 112.906 -179.984 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -147.23 30.39 0.94 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.785 179.82 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.814 ' O ' HD23 ' A' ' 66' ' ' LEU . 58.8 t -138.37 144.13 31.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.277 179.88 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.814 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.6 OUTLIER -149.8 108.44 3.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.771 -179.975 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.742 HD13 ' HE1' ' A' ' 10' ' ' PHE . 0.1 OUTLIER -108.69 133.54 52.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.001 0.429 . . . . 0.0 110.989 -179.957 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.49 ' N ' HD12 ' A' ' 67' ' ' LEU . 97.4 t -94.7 140.96 15.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.724 179.751 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.479 ' CD2' HD21 ' A' ' 76' ' ' LEU . 3.1 p90 -146.06 168.48 20.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.905 179.945 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.769 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.3 OUTLIER -125.64 -178.01 4.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.95 -179.822 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.7 t -128.27 115.81 39.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.075 179.871 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -99.51 -178.42 3.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.862 179.99 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -66.28 103.54 1.03 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.854 -179.898 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 56.82 22.73 7.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.14 179.984 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -155.28 136.34 13.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.819 -179.975 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.479 HD21 ' CD2' ' A' ' 69' ' ' TYR . 4.5 tp -93.93 154.4 17.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.878 -179.992 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.769 HD11 ' HB2' ' A' ' 70' ' ' LEU . 1.9 pp -138.27 132.92 42.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.266 -179.94 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.54 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 55.4 mt -81.33 142.06 33.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.566 179.686 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.413 HD12 ' HD3' ' A' ' 80' ' ' ARG . 0.2 OUTLIER -99.71 -71.12 0.71 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.279 -179.63 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.413 ' HD3' HD12 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -157.36 161.08 39.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.011 0.434 . . . . 0.0 111.498 -179.587 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.541 ' C ' HD13 ' A' ' 81' ' ' LEU . 3.2 tm? -112.51 125.33 54.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.566 179.94 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.522 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -136.27 -161.91 9.31 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.66 -179.918 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.4 p -150.57 -177.75 6.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.904 0.383 . . . . 0.0 110.846 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -66.77 -27.98 68.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.995 179.991 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -87.36 -24.97 24.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.193 -179.96 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.15 -73.63 0.43 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.897 -179.888 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.63 HD12 ' HB2' ' A' ' 66' ' ' LEU . 23.3 mt -61.32 -41.08 96.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.93 -179.96 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.213 -0.898 . . . . 0.0 110.868 -179.952 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 N--CA 1.458 -0.034 0 CA-C-O 120.915 0.388 . . . . 0.0 110.84 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.79 155.91 12.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.836 179.98 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.79 147.46 46.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.993 -179.936 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.744 ' HB2' HG22 ' A' ' 77' ' ' ILE . 1.2 t-20 -133.33 177.62 7.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.849 179.91 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.8 mp -143.48 132.55 22.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.969 179.968 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.429 ' HE2' HD13 ' A' ' 77' ' ' ILE . 30.1 mmtm -107.39 158.91 16.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.806 180.0 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.3 mttp -61.77 -32.67 72.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.765 179.955 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 88.8 p -63.57 -23.31 67.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.153 179.925 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.59 ' HE1' HD13 ' A' ' 67' ' ' LEU . 53.8 t80 -78.14 -32.07 50.16 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.085 -179.811 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -70.06 -47.88 60.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.128 -179.905 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -75.21 -6.49 49.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.556 -179.959 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.538 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -90.83 -22.6 20.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.976 179.937 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.666 ' CZ ' HD22 ' A' ' 27' ' ' LEU . 43.6 t80 -90.81 -70.85 0.66 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.552 -179.74 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -49.72 -35.81 23.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.212 -179.871 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.481 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 4.5 tppt? -76.57 -20.89 56.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.981 179.88 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.664 HD11 ' OE1' ' A' ' 86' ' ' GLU . 1.6 mt -89.61 -52.21 5.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.951 0.405 . . . . 0.0 110.151 179.187 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.631 HD13 ' HD2' ' A' ' 22' ' ' PHE . 4.3 mm? -49.2 -32.43 10.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.536 -179.771 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.55 ' C ' HD12 ' A' ' 19' ' ' LEU . 4.4 pp -89.65 -8.22 52.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.708 -179.629 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -96.6 40.11 1.14 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.846 0.355 . . . . 0.0 110.846 -179.954 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 70.01 27.6 72.82 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.495 -179.936 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.631 ' HD2' HD13 ' A' ' 18' ' ' LEU . 67.6 t80 -95.35 128.14 41.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.827 0.346 . . . . 0.0 110.81 -179.95 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.405 ' HB3' HG23 ' A' ' 26' ' ' VAL . 0.7 OUTLIER -56.98 119.6 6.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.915 -179.97 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.542 ' HA ' HD23 ' A' ' 27' ' ' LEU . 9.0 p-10 -82.59 -34.84 27.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.157 -179.796 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.68 -22.62 47.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.257 -179.929 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.405 HG23 ' HB3' ' A' ' 23' ' ' ASP . 21.3 t -82.48 -35.06 12.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.392 -179.871 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.666 HD22 ' CZ ' ' A' ' 14' ' ' PHE . 0.8 OUTLIER -56.98 -36.45 70.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.107 -179.69 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.404 ' N ' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -62.77 -23.36 67.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.269 -179.798 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -80.04 -33.82 38.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.138 -179.814 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.723 HG13 HD12 ' A' ' 31' ' ' ILE . 11.7 p -89.96 -43.3 14.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.262 -179.879 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.723 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -64.75 -24.7 36.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.871 179.853 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.706 HD23 ' N ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -70.84 -46.85 61.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.15 -179.844 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.706 ' N ' HD23 ' A' ' 32' ' ' LEU . 55.8 m -62.81 -25.98 68.51 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.42 -179.473 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.0 mt -90.04 -35.72 15.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.73 0.3 . . . . 0.0 111.544 -179.478 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.17 20.23 7.14 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.335 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.472 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 3.2 mttm -118.43 -55.96 2.18 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.054 179.724 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.472 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 2.3 pttt 154.65 -20.41 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.0 179.565 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.66 ' HB3' HG23 ' A' ' 33' ' ' THR . 0.0 OUTLIER -65.31 120.72 70.02 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.163 -179.627 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.51 -178.74 4.7 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.476 2.118 . . . . 0.0 112.289 179.832 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.62 HD13 ' SG ' ' A' ' 59' ' ' CYS . 59.3 mt -92.31 108.66 20.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.929 179.843 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -58.74 161.6 8.16 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.98 -179.927 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -67.14 -33.25 31.93 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.461 2.107 . . . . 0.0 112.189 179.915 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -58.9 -21.07 56.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.106 179.854 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.432 ' CE2' ' HA ' ' A' ' 61' ' ' ILE . 3.5 m-85 -57.42 -21.78 38.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.136 179.961 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 64.44 66.57 0.6 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.988 0.423 . . . . 0.0 110.963 179.999 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -93.29 106.17 18.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.861 179.911 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 42.1 m80 -124.2 175.5 7.0 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.929 179.972 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -99.31 114.55 27.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.132 -179.967 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.657 HD11 ' HG3' ' A' ' 58' ' ' GLU . 3.3 mt -61.56 159.13 13.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.837 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.66 165.74 11.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.107 -179.928 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 58.39 108.21 0.01 OUTLIER Glycine 0 CA--C 1.507 -0.429 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.809 179.754 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.4 mptt 69.14 -46.15 0.56 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.628 0.252 . . . . 0.0 111.161 179.815 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 22.6 m95 -97.03 32.14 2.22 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.994 -179.894 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.434 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.2 OUTLIER -69.3 -51.86 16.47 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.087 179.891 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.434 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 98.9 Cg_endo -80.21 46.24 2.19 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.437 2.091 . . . . 0.0 112.522 179.933 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -156.52 175.66 13.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.852 0.358 . . . . 0.0 110.88 179.849 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.655 ' O ' HG13 ' A' ' 68' ' ' VAL . 14.7 ttm105 -137.79 144.04 41.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.919 -179.942 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.657 ' HG3' HD11 ' A' ' 49' ' ' LEU . 1.1 tt0 -105.35 177.31 4.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.975 -179.895 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.62 ' SG ' HD13 ' A' ' 40' ' ' LEU . 0.5 OUTLIER -168.26 126.09 1.12 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.68 -179.992 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.467 ' CE1' HD22 ' A' ' 66' ' ' LEU . 2.6 m-70 -102.19 82.69 2.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.07 -179.734 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.713 HG21 HG23 ' A' ' 30' ' ' VAL . 4.4 mp -59.99 -26.94 37.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.771 179.662 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.426 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 23.5 mtpp -139.82 169.25 12.51 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.566 179.927 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.426 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 12.2 Cg_exo -70.04 -0.19 6.78 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.802 2.335 . . . . 0.0 112.983 -179.86 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -143.33 27.61 1.55 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.875 179.877 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.83 ' O ' HD23 ' A' ' 66' ' ' LEU . 38.9 t -139.51 152.06 22.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.938 0.399 . . . . 0.0 111.311 179.992 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.83 HD23 ' O ' ' A' ' 65' ' ' VAL . 1.0 OUTLIER -148.17 100.54 3.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.552 179.804 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.775 HD12 ' N ' ' A' ' 68' ' ' VAL . 4.2 tp -97.48 131.32 44.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.059 -179.679 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.775 ' N ' HD12 ' A' ' 67' ' ' LEU . 57.1 t -106.14 136.75 39.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.891 179.793 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.612 ' CE1' HD11 ' A' ' 76' ' ' LEU . 45.3 p90 -153.55 164.04 38.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.136 -179.921 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.736 ' HB2' HD11 ' A' ' 77' ' ' ILE . 1.4 tp -106.39 174.46 5.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.864 179.916 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.4 t -123.86 123.23 66.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.26 -179.957 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 3.7 tptp -100.15 160.97 13.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.743 179.919 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -44.27 -49.46 9.35 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.54 -179.81 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -137.89 28.3 2.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.919 179.927 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 50.6 mp0 -156.88 170.0 23.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.824 179.96 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.612 HD11 ' CE1' ' A' ' 69' ' ' TYR . 0.7 OUTLIER -129.88 141.15 50.85 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.682 179.803 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.744 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.3 pp -128.95 131.55 68.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.396 -179.724 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 72.5 mt -73.43 158.44 34.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.599 179.77 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.84 -78.33 0.58 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.045 -179.885 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.72 167.06 29.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.013 0.435 . . . . 0.0 111.253 -179.909 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.868 HD13 ' N ' ' A' ' 82' ' ' GLY . 1.5 tm? -114.19 137.72 51.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.696 179.849 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.868 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -141.26 -176.32 15.52 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.675 -179.775 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -140.88 -176.15 4.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.812 0.339 . . . . 0.0 110.895 179.985 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -67.75 -27.78 67.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.167 -179.949 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.2 m -90.02 -27.57 19.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.099 -179.97 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.664 ' OE1' HD11 ' A' ' 17' ' ' LEU . 1.1 mt-10 -80.18 -75.11 0.27 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.842 0.353 . . . . 0.0 111.015 -179.798 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.552 HD12 ' HB2' ' A' ' 66' ' ' LEU . 29.6 mt -67.17 -38.43 85.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.023 -179.943 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.192 -0.908 . . . . 0.0 111.027 179.92 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 10.3 mt . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.809 0.337 . . . . 0.0 110.92 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -66.56 160.89 24.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.819 179.987 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.9 tt -128.64 144.96 51.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.905 179.781 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.755 ' HB2' HG22 ' A' ' 77' ' ' ILE . 0.9 OUTLIER -141.48 163.33 33.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.859 -179.925 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.6 mp -124.63 125.55 44.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.858 179.998 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.604 ' HE3' HD13 ' A' ' 77' ' ' ILE . 58.8 mmtt -92.12 168.86 11.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.942 -179.969 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -60.33 -32.23 71.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.782 -179.97 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.3 m -70.83 -47.49 59.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.821 179.936 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.479 ' HE1' HD13 ' A' ' 67' ' ' LEU . 31.3 t80 -63.86 -30.7 71.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.959 -179.833 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -63.23 -46.16 88.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.996 -179.916 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.5 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 7.4 pttt -87.08 -5.6 58.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.597 -179.955 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.428 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -90.77 -15.74 29.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.082 179.778 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.889 ' O ' HD13 ' A' ' 18' ' ' LEU . 21.1 t80 -90.82 -74.33 0.5 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.633 -179.474 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.681 ' HA ' HD22 ' A' ' 18' ' ' LEU . 1.1 m-20 -79.65 -32.93 41.65 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -178.899 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.5 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.4 OUTLIER -75.41 -16.57 60.34 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.213 -179.656 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.428 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 32.7 tp -90.14 -37.41 14.22 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.402 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.889 HD13 ' O ' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -50.9 -42.95 59.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.066 179.962 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.5 pp -89.28 0.72 56.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.691 -179.531 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -98.05 32.07 2.52 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.741 0.305 . . . . 0.0 110.85 -179.965 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.79 22.97 40.54 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.503 -179.843 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.579 ' CD1' HD12 ' A' ' 18' ' ' LEU . 34.2 t80 -106.99 141.71 37.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.803 0.335 . . . . 0.0 110.769 179.834 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.889 ' O ' HG12 ' A' ' 26' ' ' VAL . 16.0 t70 -78.89 105.58 10.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.829 179.954 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.594 ' HA ' HD23 ' A' ' 27' ' ' LEU . 27.3 p30 -64.92 -14.26 59.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.455 -179.954 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.1 t -75.84 -20.99 57.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.606 0.241 . . . . 0.0 111.47 -179.866 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.889 HG12 ' O ' ' A' ' 23' ' ' ASP . 14.3 p -88.8 -27.14 5.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.71 0.291 . . . . 0.0 111.614 -179.633 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.609 HD13 ' HE1' ' A' ' 14' ' ' PHE . 1.5 pp -59.11 -37.92 78.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.84 0.352 . . . . 0.0 110.956 -179.855 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -56.89 -24.96 55.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.192 -179.842 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -78.73 -44.73 22.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.152 -179.964 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.532 HG13 HD12 ' A' ' 31' ' ' ILE . 11.5 p -80.58 -48.96 19.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.313 -179.857 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.532 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -54.0 -34.56 26.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 121.08 0.467 . . . . 0.0 110.228 179.45 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.817 HD23 ' N ' ' A' ' 33' ' ' THR . 0.9 OUTLIER -52.08 -61.34 2.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.317 179.471 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.817 ' N ' HD23 ' A' ' 32' ' ' LEU . 39.1 m -54.23 -26.81 30.64 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.564 -179.867 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 32.8 mt -70.44 -49.51 47.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.758 0.313 . . . . 0.0 111.149 -179.766 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.1 mtm180 -77.35 -55.89 5.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.99 0.424 . . . . 0.0 110.806 -179.802 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.736 ' HE2' HD21 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -64.12 -16.7 62.38 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.599 -179.967 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.553 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 0.2 OUTLIER 53.35 73.06 0.39 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.332 179.807 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.672 ' HB3' HG23 ' A' ' 33' ' ' THR . 20.4 tt0 -84.11 139.09 39.42 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.138 178.781 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -58.56 105.0 0.2 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.451 2.101 . . . . 0.0 112.034 179.894 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 50.1 mt -62.48 178.78 0.38 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.013 -179.777 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -140.14 163.52 43.52 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.779 -179.985 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -64.24 -27.91 64.19 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.602 2.202 . . . . 0.0 112.291 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.25 -17.92 64.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.247 179.942 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.426 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.6 m-85 -69.49 -10.7 59.17 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.48 -179.988 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 61.89 36.89 15.63 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.893 0.378 . . . . 0.0 110.902 -179.959 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.2 p-10 -75.77 84.42 2.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.879 179.789 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 -140.48 -177.61 5.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.061 -179.921 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.9 157.23 33.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.162 -179.945 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.58 HD11 ' HG3' ' A' ' 58' ' ' GLU . 53.9 mt -105.3 -178.35 3.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.913 180.0 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -118.08 175.17 5.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.91 -179.879 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 71.81 -138.19 26.73 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.546 -179.954 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.18 -28.19 69.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.694 0.283 . . . . 0.0 111.0 179.98 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 8.1 m95 -97.32 39.26 1.2 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.726 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.462 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 3.1 tmtp? -69.51 -51.38 16.65 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.314 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.462 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 81.9 Cg_endo -78.67 6.6 4.75 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.449 2.1 . . . . 0.0 112.878 -179.787 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -105.39 173.38 6.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.842 0.354 . . . . 0.0 110.87 179.93 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.611 ' O ' HG13 ' A' ' 68' ' ' VAL . 23.1 ttm180 -131.74 142.9 49.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.979 -179.967 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.58 ' HG3' HD11 ' A' ' 49' ' ' LEU . 1.2 tt0 -110.75 171.67 7.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.985 -179.914 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 8.3 t -160.78 118.47 2.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.719 179.882 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.591 ' CE1' HD22 ' A' ' 66' ' ' LEU . 3.8 m-70 -94.4 78.7 3.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.977 -179.858 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.524 ' CB ' HG23 ' A' ' 30' ' ' VAL . 3.7 mp -57.06 -27.12 26.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.072 179.76 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.558 ' NZ ' HG22 ' A' ' 26' ' ' VAL . 10.5 mtmm -139.37 169.26 12.71 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.708 179.991 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.402 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 13.7 Cg_exo -69.19 -3.32 11.4 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.78 2.32 . . . . 0.0 112.875 -179.834 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -141.29 26.02 2.02 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.922 179.881 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.845 ' O ' HD23 ' A' ' 66' ' ' LEU . 56.9 t -136.64 147.11 27.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.173 179.97 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.845 HD23 ' O ' ' A' ' 65' ' ' VAL . 2.4 mt -144.31 97.98 3.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.647 179.846 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.743 HD12 ' N ' ' A' ' 68' ' ' VAL . 4.2 tp -94.15 127.81 40.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.979 -179.865 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.743 ' N ' HD12 ' A' ' 67' ' ' LEU . 46.6 t -105.08 136.35 39.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.727 179.769 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -147.89 153.67 39.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.054 179.964 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.773 ' HB2' HD11 ' A' ' 77' ' ' ILE . 3.6 tp -99.18 173.13 6.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.893 -179.995 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.424 ' HA ' HD12 ' A' ' 76' ' ' LEU . 21.5 t -123.68 102.94 12.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.181 -179.966 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 13.5 tptp -73.48 162.32 29.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.758 179.962 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -44.95 -43.33 8.92 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.376 -179.86 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -145.4 29.72 1.14 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.819 179.902 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.3 mp0 -157.39 167.99 28.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.802 -179.885 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.424 HD12 ' HA ' ' A' ' 71' ' ' VAL . 10.8 tp -120.19 139.13 53.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.797 179.902 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.773 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.3 pp -128.83 131.6 68.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.339 -179.806 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 71.9 mt -73.68 137.14 43.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.704 179.742 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.09 -72.01 0.63 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.021 -179.767 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.447 ' NH2' HG11 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -161.16 170.48 20.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.849 0.357 . . . . 0.0 111.32 -179.949 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.617 HD13 ' N ' ' A' ' 82' ' ' GLY . 1.9 tm? -122.77 125.33 45.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.93 -179.943 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.617 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -135.43 -162.11 9.56 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.464 179.93 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -148.08 155.26 41.27 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.125 0.488 . . . . 0.0 110.909 -179.994 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.537 ' HA ' HD11 ' A' ' 66' ' ' LEU . 1.0 OUTLIER -49.07 -28.14 3.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.359 -179.886 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 12.1 t -90.09 -22.13 21.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.152 179.823 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -82.71 -73.56 0.39 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.263 -179.83 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.696 ' CD1' HD12 ' A' ' 66' ' ' LEU . 1.1 mp -51.36 -33.8 31.22 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.289 -179.724 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.27 -0.871 . . . . 0.0 110.873 -179.994 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.542 HD13 ' CB ' ' A' ' 76' ' ' LEU . 1.4 pp . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.765 0.317 . . . . 0.0 110.873 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.31 150.89 24.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.913 -179.974 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.3 tp -125.16 138.33 54.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.8 179.923 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.736 ' HB2' HG22 ' A' ' 77' ' ' ILE . 1.1 t-20 -118.58 169.58 9.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.835 -179.954 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 33.3 mt -132.21 112.68 12.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.881 -179.961 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.31 161.68 18.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.908 -179.989 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.7 tptt -61.38 -34.46 75.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.825 -179.985 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 39.3 m -69.69 -32.6 71.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.777 179.958 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -73.52 -38.48 65.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.856 -179.965 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -63.34 -37.58 87.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.802 -179.993 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.577 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 1.8 mttp -83.9 -25.56 30.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.234 0.54 . . . . 0.0 111.055 -179.999 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.466 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 1.2 m-20 -90.9 -9.42 46.31 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.067 179.805 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.829 ' CE1' HD13 ' A' ' 27' ' ' LEU . 47.5 t80 -91.26 -68.02 0.82 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.14 -179.604 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -91.05 -34.59 15.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.806 -179.331 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.577 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -78.68 -15.21 58.75 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.167 -179.48 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.466 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 31.6 tp -80.55 -35.18 34.74 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.957 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.704 HD13 ' CB ' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -64.01 -53.37 51.1 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.914 179.71 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.3 mt -60.08 -36.96 78.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.928 179.984 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -24.9 61.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.948 179.901 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.97 37.88 0.24 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.639 179.915 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.4 ' CB ' ' HG ' ' A' ' 17' ' ' LEU . 76.0 t80 -121.63 163.59 18.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.802 0.334 . . . . 0.0 110.866 -179.987 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -76.13 125.45 29.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.101 -179.854 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.704 ' CB ' HD13 ' A' ' 18' ' ' LEU . 7.6 p-10 -93.26 -15.82 25.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.191 179.741 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.1 m -78.83 -34.69 45.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.787 0.327 . . . . 0.0 111.047 -179.678 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 11.7 p -66.81 -27.38 39.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.389 -179.87 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.829 HD13 ' CE1' ' A' ' 14' ' ' PHE . 1.3 pp -64.78 -37.97 89.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.106 -179.803 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.801 ' O ' HD22 ' A' ' 32' ' ' LEU . 7.3 t-20 -61.52 -26.57 68.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.061 -179.988 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.412 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 2.2 mm-40 -74.81 -33.99 62.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.132 -179.869 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 1.11 HG23 HG21 ' A' ' 61' ' ' ILE . 11.7 p -90.65 -41.08 13.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.923 -179.645 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.699 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -64.12 -54.91 25.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.718 -179.301 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.801 HD22 ' O ' ' A' ' 28' ' ' ASN . 0.8 OUTLIER -50.38 -22.53 1.89 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 -179.073 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.562 ' N ' HD23 ' A' ' 32' ' ' LEU . 38.9 m -90.29 -42.57 10.9 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 120.659 0.266 . . . . 0.0 111.545 -179.725 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.977 HD21 HD21 ' A' ' 40' ' ' LEU . 21.9 mt -80.46 -31.72 37.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.952 -179.023 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.533 ' CD ' HG23 ' A' ' 31' ' ' ILE . 5.9 mtp-105 -91.38 20.39 5.28 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -179.238 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.575 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 0.6 OUTLIER -115.51 -45.67 2.9 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.11 -0.236 . . . . 0.0 111.635 -179.969 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.511 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 1.0 OUTLIER 150.99 -20.59 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 122.883 0.473 . . . . 0.0 111.082 179.55 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.15 112.11 10.67 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.129 -179.64 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.49 152.88 34.44 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.452 2.101 . . . . 0.0 112.177 179.807 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.977 HD21 HD21 ' A' ' 34' ' ' LEU . 4.3 mt -76.68 115.76 16.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.826 -179.993 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.62 164.47 3.99 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.033 -179.864 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.62 -13.17 32.28 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.574 2.183 . . . . 0.0 112.604 179.943 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -83.57 3.61 31.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.407 -179.947 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -95.48 20.16 9.91 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.693 0.282 . . . . 0.0 111.181 179.999 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 58.0 mm-40 58.83 34.24 23.57 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.896 179.927 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.0 p-10 -82.9 114.88 21.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.892 -179.975 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -168.72 178.03 4.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.959 179.991 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.42 148.02 43.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.117 179.981 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.533 HD11 ' CG ' ' A' ' 58' ' ' GLU . 90.7 mt -102.4 -177.11 3.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.834 179.955 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.77 176.33 5.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.867 -179.915 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 67.93 -136.35 30.94 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.577 179.965 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.44 -25.84 68.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.718 0.295 . . . . 0.0 111.094 -179.869 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.435 ' HD1' HG11 ' A' ' 68' ' ' VAL . 18.5 m-90 -96.65 38.77 1.19 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.912 0.387 . . . . 0.0 110.984 -179.956 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.419 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.1 OUTLIER -73.13 -52.21 5.59 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.011 179.947 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 88.4 Cg_endo -83.2 13.89 2.52 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.646 2.231 . . . . 0.0 112.803 179.973 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.411 ' CD2' ' HG ' ' A' ' 79' ' ' LEU . 96.1 m-85 -114.14 179.18 4.03 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.863 0.363 . . . . 0.0 110.999 -179.921 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.593 HH21 HG21 ' A' ' 71' ' ' VAL . 0.0 OUTLIER -131.14 149.8 52.43 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.886 -179.985 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.533 ' CG ' HD11 ' A' ' 49' ' ' LEU . 0.8 OUTLIER -129.91 169.87 14.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.923 -179.963 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.538 ' SG ' HD13 ' A' ' 40' ' ' LEU . 37.5 t -165.04 129.21 2.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.931 -179.951 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.414 ' CD2' ' HB3' ' A' ' 66' ' ' LEU . 23.5 m170 -91.84 83.24 5.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.848 179.837 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 1.11 HG21 HG23 ' A' ' 30' ' ' VAL . 3.5 mp -56.91 -50.93 73.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.122 -179.966 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.439 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 0.0 OUTLIER -114.82 172.41 3.64 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.483 179.965 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.439 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 16.7 Cg_exo -67.17 -4.28 11.34 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.554 2.169 . . . . 0.0 112.851 -179.874 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -146.81 29.09 1.02 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.874 179.933 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.791 ' O ' HD23 ' A' ' 66' ' ' LEU . 52.8 t -136.47 145.01 31.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.988 0.423 . . . . 0.0 111.383 179.934 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.791 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.0 OUTLIER -159.13 111.22 2.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.595 179.745 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.488 HD12 ' O ' ' A' ' 68' ' ' VAL . 0.3 OUTLIER -111.68 139.03 47.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.875 0.369 . . . . 0.0 111.103 -179.745 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.488 ' O ' HD12 ' A' ' 67' ' ' LEU . 40.9 t -88.94 139.36 17.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.801 179.84 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.403 ' CD1' ' N ' ' A' ' 69' ' ' TYR . 2.3 p90 -153.84 175.58 13.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.037 -179.952 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.601 ' HB2' HD11 ' A' ' 77' ' ' ILE . 4.5 tp -130.16 150.13 51.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.888 179.979 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.593 HG21 HH21 ' A' ' 57' ' ' ARG . 21.6 t -106.97 111.43 35.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.109 179.988 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.68 168.72 9.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.89 179.963 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.21 108.78 1.14 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.93 -179.922 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.1 t0 57.98 24.2 10.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.069 179.885 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -160.02 141.21 12.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.817 179.989 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.542 ' CB ' HD13 ' A' ' 2' ' ' LEU . 0.5 OUTLIER -119.93 148.16 43.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.896 -179.972 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.736 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.1 pp -131.49 134.32 60.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.26 -179.913 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 62.7 mt -84.93 135.39 34.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.671 179.781 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.411 ' HG ' ' CD2' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -93.73 -61.43 1.55 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.045 -179.927 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.4 175.05 4.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.973 0.416 . . . . 0.0 111.297 179.955 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.873 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.1 tm? -116.13 142.36 46.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.793 -179.971 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.873 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -148.5 -178.02 23.26 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.507 179.966 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 58.7 m -138.45 177.05 8.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.836 0.351 . . . . 0.0 110.907 179.944 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 8.4 t-80 -64.24 -29.99 71.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.943 -179.969 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.9 m -88.49 -29.95 19.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.895 -179.96 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.27 -68.13 0.55 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.886 -179.949 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.753 HD12 HD12 ' A' ' 66' ' ' LEU . 25.3 mt -69.7 -32.68 71.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.931 -179.979 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.938 179.983 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 8.0 mt . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.889 0.376 . . . . 0.0 110.927 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.67 152.69 40.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.957 -179.966 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.444 HD11 HD21 ' A' ' 78' ' ' LEU . 2.7 tp -120.75 145.27 47.69 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.874 179.931 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.485 ' HB2' HG22 ' A' ' 77' ' ' ILE . 8.0 t30 -129.88 171.89 12.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.752 179.957 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.453 HD11 HH21 ' A' ' 35' ' ' ARG . 4.6 mp -140.79 119.97 12.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.829 179.997 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -93.58 -176.56 4.12 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.917 179.973 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.7 mmtt -74.18 -31.36 62.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.863 -179.972 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.57 -39.76 73.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.99 -179.96 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -71.95 -33.24 68.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.885 -179.951 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -59.42 -47.09 86.78 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.989 179.964 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.542 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 0.9 OUTLIER -80.34 -13.45 59.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.12 179.892 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.421 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 3.2 m-20 -90.72 -11.88 38.31 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.037 179.715 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.596 ' O ' HD13 ' A' ' 18' ' ' LEU . 76.6 t80 -90.69 -65.47 1.01 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.214 -179.612 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.782 ' HA ' HD22 ' A' ' 18' ' ' LEU . 1.8 t70 -91.36 -36.34 13.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.95 -179.324 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.542 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 2.0 mptt -72.37 -36.54 68.75 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.125 -179.046 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.548 ' O ' HD23 ' A' ' 17' ' ' LEU . 1.8 tt -61.06 -32.07 71.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.996 0.427 . . . . 0.0 109.908 179.15 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.782 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.2 OUTLIER -62.51 -23.49 66.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.146 179.89 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -90.06 15.05 10.84 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.446 -179.995 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -127.6 47.91 2.32 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.823 0.344 . . . . 0.0 110.844 -179.979 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.27 30.05 65.5 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.482 -179.923 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.523 ' CD1' HD12 ' A' ' 18' ' ' LEU . 8.6 t80 -120.73 124.55 45.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.784 0.326 . . . . 0.0 110.765 -179.921 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.435 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 25.5 t0 -79.53 140.47 37.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.204 -179.744 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.691 ' HA ' HD23 ' A' ' 27' ' ' LEU . 7.3 p-10 -93.68 16.35 14.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.388 -179.977 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.5 t -90.06 -33.51 16.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.76 0.314 . . . . 0.0 111.348 -179.741 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.3 t -84.14 -38.14 13.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.573 -179.623 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.691 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.4 OUTLIER -59.86 -36.6 77.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.16 -179.667 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.529 ' O ' HD12 ' A' ' 32' ' ' LEU . 26.9 t30 -52.23 -46.07 65.57 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.076 -179.927 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.532 ' C ' HD12 ' A' ' 32' ' ' LEU . 5.3 mt-10 -64.94 -16.65 63.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.115 179.794 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 95.2 t -90.36 -74.37 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.034 0.445 . . . . 0.0 111.658 -179.541 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.7 mp -45.72 -44.03 4.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.874 -0.603 . . . . 0.0 112.263 -179.005 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.939 HD13 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -58.56 -19.65 39.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.72 0.295 . . . . 0.0 111.512 -179.431 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.939 ' N ' HD13 ' A' ' 32' ' ' LEU . 99.1 m -84.84 -28.74 25.85 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.83 0.348 . . . . 0.0 111.092 179.996 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.581 HD21 HD11 ' A' ' 40' ' ' LEU . 73.2 mt -89.9 -34.16 16.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.597 -179.349 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.453 HH21 HD11 ' A' ' 6' ' ' LEU . 4.5 mtp-105 -93.31 20.31 7.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.852 -179.346 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.592 ' HE3' HD23 ' A' ' 32' ' ' LEU . 10.3 mttm -110.04 -55.5 2.44 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 121.159 -0.216 . . . . 0.0 110.98 179.719 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.45 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 159.72 -20.53 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.27 179.613 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -83.38 118.33 71.25 Favored Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 116.713 -0.222 . . . . 0.0 111.083 -179.71 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -75.99 -179.39 5.16 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.462 2.108 . . . . 0.0 112.295 179.776 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.581 HD11 HD21 ' A' ' 34' ' ' LEU . 8.7 mt -98.89 157.35 16.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.779 179.968 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -96.56 157.75 34.84 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.024 -179.921 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.29 -3.28 13.68 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.632 2.221 . . . . 0.0 112.817 -179.982 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -92.6 17.71 9.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.694 0.283 . . . . 0.0 111.206 179.858 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -113.46 21.52 15.07 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.744 0.307 . . . . 0.0 110.985 179.901 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 62.79 43.92 6.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.828 179.986 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.7 p-10 -88.75 66.21 7.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.853 179.946 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -120.28 178.3 4.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.882 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.77 163.06 28.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.087 -179.991 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.777 HD21 ' OE1' ' A' ' 58' ' ' GLU . 5.4 mt -106.7 176.76 5.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.886 179.961 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.3 mmtt -116.67 157.07 26.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.041 179.989 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 82.68 -140.22 20.09 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.543 179.978 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm -58.47 -22.92 56.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.737 0.304 . . . . 0.0 111.219 179.999 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 5.0 m95 -96.17 38.48 1.19 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.928 179.953 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.435 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -75.4 -52.19 3.06 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.116 -179.922 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.435 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 90.1 Cg_endo -79.75 47.06 2.4 Favored 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 122.43 2.087 . . . . 0.0 112.347 -179.933 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.721 ' CD1' HD21 ' A' ' 79' ' ' LEU . 77.9 m-85 -154.57 178.37 10.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.856 179.878 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -137.17 134.76 36.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.004 -179.981 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.777 ' OE1' HD21 ' A' ' 49' ' ' LEU . 3.5 tt0 -98.8 171.85 7.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.79 179.891 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.535 ' SG ' HD13 ' A' ' 40' ' ' LEU . 14.8 t -168.36 116.66 0.71 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.901 179.985 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.557 ' CD2' HD22 ' A' ' 66' ' ' LEU . 11.3 m170 -93.31 79.04 4.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.915 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.585 HD11 ' HB3' ' A' ' 67' ' ' LEU . 2.5 mp -55.19 -26.87 19.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.193 179.843 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.425 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 2.7 mtpp -137.72 166.93 22.65 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.767 -179.751 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.425 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 48.2 Cg_endo -68.58 -2.57 9.51 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.351 2.034 . . . . 0.0 112.789 179.929 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -143.47 27.4 1.54 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.662 179.62 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.846 ' O ' HD23 ' A' ' 66' ' ' LEU . 60.9 t -136.9 146.38 28.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.208 -179.956 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.846 HD23 ' O ' ' A' ' 65' ' ' VAL . 5.8 mt -144.24 102.85 3.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.525 179.421 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.725 HD12 ' N ' ' A' ' 68' ' ' VAL . 5.2 tp -102.63 131.42 49.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.141 -179.651 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.725 ' N ' HD12 ' A' ' 67' ' ' LEU . 46.9 t -104.71 138.17 30.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.841 179.843 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.472 ' CD1' HD21 ' A' ' 76' ' ' LEU . 52.5 p90 -157.35 161.59 39.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.063 179.993 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.755 ' HB2' HD11 ' A' ' 77' ' ' ILE . 1.2 tp -109.36 -176.31 2.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.856 180.0 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.439 ' HA ' HD12 ' A' ' 76' ' ' LEU . 21.4 t -127.27 104.82 12.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.137 -179.99 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.62 172.61 8.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.871 179.923 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -57.99 102.55 0.11 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.906 179.893 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 58.17 24.75 11.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.961 -179.899 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -151.53 162.49 40.88 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.803 180.0 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.472 HD21 ' CD1' ' A' ' 69' ' ' TYR . 8.1 tp -123.41 147.66 46.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.832 -179.935 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.755 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.4 pp -131.95 128.92 60.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.154 -179.885 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.444 HD21 HD11 ' A' ' 4' ' ' LEU . 70.1 mt -73.83 155.4 38.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.684 179.744 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.721 HD21 ' CD1' ' A' ' 56' ' ' PHE . 0.3 OUTLIER -117.21 -68.16 0.94 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.94 -179.909 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.81 166.75 29.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.09 179.966 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.836 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.2 tm? -121.27 137.85 54.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.824 -179.952 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.836 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -154.83 -164.67 13.18 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.638 -179.988 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.9 p -142.57 176.67 8.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.892 0.377 . . . . 0.0 110.875 179.997 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 26.7 t-80 -59.27 -27.5 65.87 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.049 -179.904 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.6 m -78.85 -28.89 44.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.087 -179.878 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.412 ' HB3' HD12 ' A' ' 87' ' ' LEU . 1.2 tt0 -84.24 -72.98 0.44 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.023 -179.963 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.46 ' H ' HD12 ' A' ' 87' ' ' LEU . 6.6 mp -60.72 -39.93 90.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.021 -179.964 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.9 -179.961 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 tpt . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.886 0.374 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.559 HD13 ' HB2' ' A' ' 76' ' ' LEU . 3.2 pp -57.07 165.94 1.18 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.073 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.412 ' HD2' ' N ' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -82.36 153.99 25.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.916 -179.875 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.412 ' N ' ' HD2' ' A' ' 3' ' ' LYS . 3.1 tp -121.98 146.3 47.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.842 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.599 ' HB2' HG22 ' A' ' 77' ' ' ILE . 3.6 t30 -136.03 173.68 11.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.861 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.3 mp -144.56 138.02 27.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.981 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.3 mmtp -106.03 171.04 7.56 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.844 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 41.0 tttt -59.23 -30.08 67.99 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.99 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.1 t -70.42 -55.89 7.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.958 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.428 ' HE1' HD13 ' A' ' 67' ' ' LEU . 49.8 t80 -59.08 -33.8 71.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.973 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -60.56 -42.05 95.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.938 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.573 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 3.7 mtpt -89.97 -16.42 29.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.023 0.44 . . . . 0.0 111.464 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -90.75 -11.48 39.41 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.293 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.778 ' O ' HD13 ' A' ' 18' ' ' LEU . 13.9 t80 -90.34 -69.88 0.7 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.806 0.336 . . . . 0.0 111.349 -179.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.776 ' HA ' HD22 ' A' ' 18' ' ' LEU . 5.4 t0 -90.76 -29.6 17.53 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -178.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.573 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.6 OUTLIER -79.0 -17.76 54.81 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.374 -179.284 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.409 ' O ' ' HB3' ' A' ' 22' ' ' PHE . 38.2 tp -87.18 -34.5 19.0 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 179.295 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.778 HD13 ' O ' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -51.78 -49.43 62.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.851 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 pp -84.28 2.48 39.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.708 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.75 32.02 2.74 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.938 0.399 . . . . 0.0 110.781 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.86 22.99 43.59 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.524 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.534 ' CD1' HD12 ' A' ' 18' ' ' LEU . 35.9 t80 -103.77 139.28 39.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.832 0.349 . . . . 0.0 110.709 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.835 ' O ' HG12 ' A' ' 26' ' ' VAL . 45.6 t0 -70.48 97.79 1.35 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.823 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.682 ' HA ' HD23 ' A' ' 27' ' ' LEU . 2.1 p30 -68.56 -12.71 61.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.486 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.2 p -73.96 -24.78 59.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.684 -0.234 . . . . 0.0 111.358 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.835 HG12 ' O ' ' A' ' 23' ' ' ASP . 11.4 p -86.06 -26.2 6.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.465 -179.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.682 HD23 ' HA ' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -64.33 -37.24 86.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.833 0.349 . . . . 0.0 110.899 -179.897 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -55.04 -22.19 14.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.315 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -85.94 -46.8 10.22 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.78 0.324 . . . . 0.0 111.362 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.691 HG13 HD12 ' A' ' 31' ' ' ILE . 9.5 p -75.04 -46.35 40.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.182 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.691 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -66.19 -15.87 19.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.795 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.501 HD23 ' N ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -80.4 -27.87 38.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.257 -179.823 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.501 ' N ' HD23 ' A' ' 32' ' ' LEU . 58.0 m -87.34 -28.02 22.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.74 -179.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.792 HD21 HD21 ' A' ' 40' ' ' LEU . 65.7 mt -90.2 -33.05 16.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.671 -179.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.8 mtp-105 -93.29 20.21 7.31 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.457 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -116.12 -55.94 2.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.583 0.23 . . . . 0.0 111.071 179.673 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.457 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.1 OUTLIER 158.27 -20.48 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.14 179.612 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.87 111.68 9.11 Favored Pre-proline 0 CA--C 1.53 0.182 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.067 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.69 156.8 53.07 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.428 2.085 . . . . 0.0 112.181 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.792 HD21 HD21 ' A' ' 34' ' ' LEU . 67.2 mt -65.66 141.8 58.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.96 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -90.15 155.92 46.67 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.04 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.02 -9.06 24.04 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.636 2.224 . . . . 0.0 112.576 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.66 3.68 31.89 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.473 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -94.41 17.99 12.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.611 0.243 . . . . 0.0 111.255 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 54.97 37.36 28.72 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.784 0.326 . . . . 0.0 110.998 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -77.35 121.44 23.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.057 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -172.95 -170.04 0.62 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.886 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.19 134.24 37.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.048 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.454 HD21 ' HB2' ' A' ' 58' ' ' GLU . 3.9 mp -76.68 177.79 7.26 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.936 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.5 mtmm -113.89 152.65 30.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.891 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.36 -134.92 12.23 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.554 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.99 -13.0 60.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.654 0.264 . . . . 0.0 111.382 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 13.2 m95 -96.56 39.06 1.17 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.796 0.331 . . . . 0.0 110.875 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.461 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 6.9 tttm -69.25 -51.02 18.42 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.47 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 74.6 Cg_endo -78.36 47.88 2.54 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.305 2.003 . . . . 0.0 112.654 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.664 ' CE1' HD21 ' A' ' 79' ' ' LEU . 70.2 m-85 -154.24 170.96 20.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.808 0.337 . . . . 0.0 110.879 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.2 ttm105 -130.46 134.79 47.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.052 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.454 ' HB2' HD21 ' A' ' 49' ' ' LEU . 1.5 tm-20 -108.04 162.6 13.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.952 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 15.0 t -171.09 114.22 0.41 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.771 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.452 ' O ' ' CG ' ' A' ' 60' ' ' HIS . 16.9 p80 -90.18 85.11 6.17 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.077 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.581 HG21 HG23 ' A' ' 30' ' ' VAL . 3.8 mp -53.86 -26.85 14.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.968 179.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.542 ' HB2' HG23 ' A' ' 65' ' ' VAL . 18.3 mmmt -135.57 161.72 61.38 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.443 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.54 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 37.8 Cg_endo -66.16 -2.3 6.72 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.265 1.976 . . . . 0.0 112.89 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -137.99 23.7 2.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.794 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.812 ' O ' HD23 ' A' ' 66' ' ' LEU . 48.3 t -135.71 149.15 27.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.141 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.812 HD23 ' O ' ' A' ' 65' ' ' VAL . 2.1 mt -147.22 85.17 1.59 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.621 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.719 HD12 ' N ' ' A' ' 68' ' ' VAL . 4.9 tp -86.59 127.87 34.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.124 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.719 ' N ' HD12 ' A' ' 67' ' ' LEU . 52.0 t -102.4 138.08 28.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.011 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -151.88 170.74 19.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.954 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.747 ' HB2' HD11 ' A' ' 77' ' ' ILE . 7.8 tp -122.82 151.04 42.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.954 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 28.2 t -102.86 109.6 27.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.125 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.88 173.7 6.19 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.77 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -59.95 103.96 0.26 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.941 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 54.16 24.65 5.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.15 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -150.48 139.58 21.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.875 0.369 . . . . 0.0 110.955 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.559 ' HB2' HD13 ' A' ' 2' ' ' LEU . 6.2 tp -111.16 150.04 30.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.818 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.747 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.2 pp -135.88 130.34 48.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.44 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 80.6 mt -81.24 127.85 33.15 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.624 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.664 HD21 ' CE1' ' A' ' 56' ' ' PHE . 0.0 OUTLIER -88.34 -73.3 0.5 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.055 -179.77 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.455 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -155.92 174.27 15.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.987 -179.883 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.751 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.4 tm? -127.35 139.36 52.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.856 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.751 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -151.55 -176.69 24.59 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.453 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 70.2 m -132.85 167.59 19.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.854 0.359 . . . . 0.0 110.753 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -56.76 -31.16 64.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.923 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.5 m -90.33 -22.7 21.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.325 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.58 -67.54 0.78 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.367 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.526 HD12 ' CD1' ' A' ' 66' ' ' LEU . 25.8 mt -51.33 -26.02 6.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.363 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.885 179.989 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.673 0.273 . . . . 0.0 111.112 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.453 ' H ' HD12 ' A' ' 2' ' ' LEU . 2.1 mp -78.2 174.5 11.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.85 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.43 160.24 7.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.889 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.718 HD21 HD11 ' A' ' 78' ' ' LEU . 0.4 OUTLIER -125.21 155.86 39.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.043 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.811 ' HB2' HG22 ' A' ' 77' ' ' ILE . 0.8 OUTLIER -149.61 -178.08 6.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.944 -179.915 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 21.7 mt -140.23 141.02 35.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.847 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.633 ' HE2' HD13 ' A' ' 77' ' ' ILE . 14.4 mmtm -115.17 171.9 7.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.928 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.3 mtmm -70.19 -33.15 71.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.927 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.48 -34.38 78.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.827 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -66.51 -29.96 70.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.874 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -64.31 -48.61 74.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.6 mtpt -69.92 -24.46 63.38 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.042 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.523 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 7.1 m-20 -90.07 -22.98 21.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.02 0.438 . . . . 0.0 111.049 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.772 ' O ' HD23 ' A' ' 18' ' ' LEU . 73.4 t80 -90.9 -39.21 12.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.55 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -93.05 -58.06 2.44 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.105 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -47.21 68.58 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.57 HD23 ' CB ' ' A' ' 22' ' ' PHE . 3.0 tt -48.17 -39.48 21.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.235 0.54 . . . . 0.0 110.899 -179.136 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.772 HD23 ' O ' ' A' ' 14' ' ' PHE . 2.3 mm? -62.64 -32.43 73.48 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.904 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 19' ' ' LEU . 21.0 mt -90.07 12.73 16.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.301 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -113.86 29.55 7.92 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.874 0.369 . . . . 0.0 110.86 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.23 22.88 46.58 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.796 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.72 ' HD2' HD13 ' A' ' 18' ' ' LEU . 83.4 t80 -113.34 122.93 48.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.923 0.392 . . . . 0.0 110.817 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.417 ' O ' ' CD2' ' A' ' 22' ' ' PHE . 3.4 t0 -58.37 159.66 5.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.867 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.665 ' HA ' HD23 ' A' ' 27' ' ' LEU . 22.7 p-10 -108.69 -29.09 8.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.073 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.3 t -55.5 -23.57 26.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.169 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 20.6 t -79.46 -46.72 22.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.282 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.665 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -58.82 -28.57 66.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.94 -179.874 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -68.23 -15.77 63.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.228 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -90.14 -37.1 14.43 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.344 -179.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.771 HG13 ' CD1' ' A' ' 31' ' ' ILE . 7.5 p -82.49 -34.26 11.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.819 0.342 . . . . 0.0 111.155 -179.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.771 ' CD1' HG13 ' A' ' 30' ' ' VAL . 1.6 mp -76.47 -23.31 15.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.789 179.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.55 HD23 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -74.5 -24.77 59.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.076 -179.962 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.55 ' N ' HD23 ' A' ' 32' ' ' LEU . 89.4 m -90.1 -22.2 21.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.707 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.765 HD21 HD21 ' A' ' 40' ' ' LEU . 12.5 mt -90.45 -42.42 10.88 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 54.9 mtt180 -77.75 -40.27 41.56 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.467 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.2 OUTLIER -53.47 -55.78 22.39 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 121.197 -0.201 . . . . 0.0 111.485 -179.162 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.467 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 157.45 -20.41 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.087 179.736 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.37 123.03 27.45 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.159 -179.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.35 162.95 35.45 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.45 2.1 . . . . 0.0 112.264 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.765 HD21 HD21 ' A' ' 34' ' ' LEU . 83.6 mt -94.43 103.07 15.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.731 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -57.12 153.23 25.74 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.003 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -69.22 -10.35 28.75 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.504 2.136 . . . . 0.0 112.544 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.54 5.84 29.73 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.34 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -84.25 2.91 37.8 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.724 -0.216 . . . . 0.0 111.312 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 61.93 40.15 12.79 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.88 0.372 . . . . 0.0 111.033 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -78.71 87.21 4.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.767 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -120.53 176.06 5.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.038 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.1 175.26 0.54 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.11 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.73 HD11 HG22 ' A' ' 68' ' ' VAL . 0.2 OUTLIER -113.7 -175.74 2.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.775 179.973 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.5 mmtm -135.29 157.61 46.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.879 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.06 -116.61 4.71 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.578 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.62 -24.79 26.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.784 0.326 . . . . 0.0 110.997 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 10.7 m95 -97.43 33.18 2.06 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.879 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.475 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 12.1 tttm -57.73 -50.19 89.49 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.405 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 72.3 Cg_endo -77.3 4.39 5.92 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.323 2.015 . . . . 0.0 113.009 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -106.75 174.84 5.71 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.753 0.311 . . . . 0.0 110.926 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.438 ' O ' HG13 ' A' ' 68' ' ' VAL . 10.1 ttm180 -126.37 150.66 48.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.907 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.478 ' HG3' HD11 ' A' ' 49' ' ' LEU . 6.5 tt0 -111.51 172.16 7.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.893 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.527 ' SG ' HD13 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -156.86 116.71 3.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.788 179.947 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.714 ' CE1' HD22 ' A' ' 66' ' ' LEU . 10.3 m-70 -95.76 80.36 3.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.054 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.697 HD13 ' CG2' ' A' ' 30' ' ' VAL . 3.7 mp -67.23 -38.98 82.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.04 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.432 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 5.0 mttm -122.27 168.3 11.97 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.748 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.432 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 55.3 Cg_endo -69.67 -2.08 9.5 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.322 2.015 . . . . 0.0 112.824 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.9 p30 -144.35 26.88 1.44 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.773 179.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.854 ' O ' HD23 ' A' ' 66' ' ' LEU . 90.6 t -133.28 141.13 45.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.102 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.854 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.0 OUTLIER -157.19 94.06 1.37 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.632 179.749 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.571 HD12 ' O ' ' A' ' 68' ' ' VAL . 0.2 OUTLIER -101.72 136.55 41.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.918 -179.859 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.73 HG22 HD11 ' A' ' 49' ' ' LEU . 38.8 t -84.63 140.79 15.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.011 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.731 ' CD1' HD11 ' A' ' 76' ' ' LEU . 32.0 p90 -143.87 158.76 43.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.889 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.751 ' HB2' HD11 ' A' ' 77' ' ' ILE . 4.5 tp -105.37 164.24 12.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.886 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.2 t -114.55 115.93 51.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.058 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -111.39 170.72 7.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.811 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.5 p-10 -64.47 103.81 0.71 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.817 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.3 t70 60.46 19.53 9.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.198 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -151.34 143.09 23.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.843 0.354 . . . . 0.0 110.848 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.731 HD11 ' CD1' ' A' ' 69' ' ' TYR . 8.2 tt -119.35 139.8 51.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.914 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.811 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.4 pp -122.9 135.54 62.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.177 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.718 HD11 HD21 ' A' ' 4' ' ' LEU . 64.0 mt -76.29 143.03 41.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.75 179.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.4 -70.88 0.75 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.11 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.438 ' NH1' HD21 ' A' ' 87' ' ' LEU . 0.1 OUTLIER -154.57 173.04 16.86 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.95 0.405 . . . . 0.0 111.42 -179.859 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.624 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.4 tm? -112.67 133.62 54.61 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.91 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.624 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -136.25 171.78 22.69 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.427 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 18.1 m -135.16 170.15 16.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.777 0.322 . . . . 0.0 110.898 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -58.99 -29.37 67.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.993 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.4 t -90.01 -28.29 19.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.987 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.28 -71.74 0.37 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.022 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.635 HD12 HD12 ' A' ' 66' ' ' LEU . 13.6 mt -69.33 -34.87 75.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.03 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.242 -0.885 . . . . 0.0 110.901 -179.955 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mtp . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.877 0.37 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.9 mt 60.05 -177.25 0.1 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.918 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.403 ' HD2' ' N ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -52.86 151.36 4.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.044 179.97 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.742 HD11 HD11 ' A' ' 78' ' ' LEU . 7.6 tt -115.73 136.31 53.19 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.9 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.74 ' HB2' HG22 ' A' ' 77' ' ' ILE . 10.2 t30 -119.39 175.34 5.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.853 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 17.8 mt -141.98 114.05 8.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.011 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.8 mmpp? -95.64 -177.91 4.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.876 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.94 -31.2 56.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.847 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.4 -31.24 63.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.922 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -79.42 -30.91 42.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.98 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -59.5 -45.58 91.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.993 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.46 ' HA ' ' CB ' ' A' ' 16' ' ' LYS . 4.0 mttt -82.02 -18.96 41.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.261 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.485 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 6.3 m-20 -90.5 -17.39 27.17 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.083 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.501 ' O ' HD21 ' A' ' 18' ' ' LEU . 88.7 t80 -91.35 -65.48 1.01 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.22 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.453 ' O ' HD12 ' A' ' 19' ' ' LEU . 10.6 t70 -90.86 -45.62 8.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.138 -179.118 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.46 ' CB ' ' HA ' ' A' ' 12' ' ' LYS . 2.9 ttmt -70.55 -14.56 62.55 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.393 -179.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.485 ' HB2' ' HA ' ' A' ' 13' ' ' ASP . 26.6 tp -79.65 -39.12 32.16 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.787 HD13 ' CB ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -68.27 -43.11 78.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.711 179.734 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.453 HD12 ' O ' ' A' ' 15' ' ' ASP . 0.4 OUTLIER -65.51 -34.21 77.73 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.695 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -65.23 -24.62 67.39 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.002 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 133.13 41.93 0.17 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.546 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -124.34 140.67 52.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.802 0.334 . . . . 0.0 110.885 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.527 ' OD2' HG23 ' A' ' 26' ' ' VAL . 2.2 t70 -63.68 114.34 3.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.944 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.787 ' CB ' HD13 ' A' ' 18' ' ' LEU . 7.3 p-10 -72.08 -32.28 66.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.4 t -60.65 -49.84 75.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.383 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.527 HG23 ' OD2' ' A' ' 23' ' ' ASP . 60.1 t -51.46 -35.29 16.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.439 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.598 HD12 HD13 ' A' ' 31' ' ' ILE . 0.4 OUTLIER -66.42 -31.81 72.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.899 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -55.24 -47.24 75.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.931 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.4 ' HA ' HD22 ' A' ' 32' ' ' LEU . 2.6 mt-10 -57.39 -20.97 33.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.135 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.756 HG21 HG11 ' A' ' 65' ' ' VAL . 53.7 t -87.66 -69.4 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.011 0.434 . . . . 0.0 111.203 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.598 HD13 HD12 ' A' ' 27' ' ' LEU . 1.8 mp -48.9 -54.15 5.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.083 -179.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.741 HD23 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -55.27 -23.32 22.28 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.608 0.242 . . . . 0.0 111.281 -179.393 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.741 ' N ' HD23 ' A' ' 32' ' ' LEU . 82.0 m -89.93 -26.22 20.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.757 0.313 . . . . 0.0 111.157 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.718 HD21 HD21 ' A' ' 40' ' ' LEU . 73.0 mt -90.1 -30.49 17.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.402 -179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.419 ' CD ' HG23 ' A' ' 31' ' ' ILE . 38.1 mtm180 -95.17 20.16 9.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.722 -179.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.469 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -113.79 -55.58 2.49 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 121.1 -0.24 . . . . 0.0 111.071 179.966 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.469 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 157.43 -20.6 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.114 179.605 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.96 110.9 3.96 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.01 -179.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.22 147.76 33.55 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.53 2.154 . . . . 0.0 112.248 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.775 HD13 ' SG ' ' A' ' 59' ' ' CYS . 3.7 mt -80.89 111.9 17.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.763 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -57.67 155.32 21.86 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.137 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -67.19 -11.58 32.74 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.616 2.211 . . . . 0.0 112.531 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.94 4.77 28.2 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.405 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -94.72 19.06 10.53 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.189 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 11.3 mp0 60.29 41.33 16.6 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.88 0.371 . . . . 0.0 110.984 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.1 p-10 -88.5 96.52 10.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.851 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 56.4 m80 -143.78 177.52 8.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.895 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.88 167.3 6.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.195 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.671 HD11 ' HG3' ' A' ' 58' ' ' GLU . 6.3 mt -114.49 -179.0 3.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.917 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.3 mtpp -131.27 153.98 48.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.843 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 100.16 -109.07 3.62 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.608 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.3 mmtt -101.58 -23.35 14.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.746 0.307 . . . . 0.0 111.111 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 4.9 m95 -96.07 29.13 2.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.032 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.552 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 1.0 OUTLIER -59.04 -54.65 54.38 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.31 -179.93 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 27.1 Cg_endo -62.73 -10.49 19.92 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.267 1.978 . . . . 0.0 112.507 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.617 ' HD1' HD13 ' A' ' 70' ' ' LEU . 13.6 m-85 -99.52 168.26 10.08 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.802 0.334 . . . . 0.0 110.834 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.608 ' O ' HG13 ' A' ' 68' ' ' VAL . 5.0 ttp180 -120.51 150.05 41.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.922 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.671 ' HG3' HD11 ' A' ' 49' ' ' LEU . 2.0 tt0 -104.14 172.96 6.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.009 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.775 ' SG ' HD13 ' A' ' 40' ' ' LEU . 7.0 t -171.1 105.1 0.23 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.76 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.754 ' ND1' HD22 ' A' ' 66' ' ' LEU . 6.7 m170 -78.53 91.83 4.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.041 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.56 ' H ' HD12 ' A' ' 61' ' ' ILE . 4.1 mp -61.78 -41.33 90.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.957 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.448 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 0.2 OUTLIER -130.45 173.84 5.34 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.488 179.968 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.448 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 18.2 Cg_exo -66.15 -4.95 11.28 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.663 2.242 . . . . 0.0 112.796 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -145.13 29.71 1.17 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.866 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.878 ' O ' HD23 ' A' ' 66' ' ' LEU . 77.3 t -143.41 138.21 26.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.237 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.885 HD12 HD13 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -154.22 110.46 3.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.413 179.664 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.581 HD12 ' N ' ' A' ' 68' ' ' VAL . 0.1 OUTLIER -112.62 133.42 54.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.035 -179.781 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.612 HG22 HD11 ' A' ' 49' ' ' LEU . 37.8 t -91.17 142.68 12.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.785 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.592 ' CD2' HD11 ' A' ' 76' ' ' LEU . 54.2 p90 -154.33 163.3 40.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.855 0.359 . . . . 0.0 111.111 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.617 HD13 ' HD1' ' A' ' 56' ' ' PHE . 7.0 tp -110.4 169.63 8.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.776 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 18.4 t -123.19 109.38 23.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.264 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.16 161.53 18.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.8 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -43.91 -61.61 1.39 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.445 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -123.85 28.3 6.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.905 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.7 mp0 -160.16 174.33 14.42 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.843 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.592 HD11 ' CD2' ' A' ' 69' ' ' TYR . 4.4 tt -136.42 149.06 48.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.736 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.74 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.3 pp -132.4 130.09 59.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.329 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.742 HD11 HD11 ' A' ' 4' ' ' LEU . 52.0 mt -76.46 137.39 39.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.612 179.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.17 -69.05 0.77 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.217 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.66 153.83 23.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.372 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.606 ' C ' HD13 ' A' ' 81' ' ' LEU . 3.2 tm? -113.13 126.96 56.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.667 179.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.72 ' HA3' HD11 ' A' ' 87' ' ' LEU . . . -144.71 -171.48 14.57 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.557 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.465 ' O ' HD12 ' A' ' 87' ' ' LEU . 15.3 t -127.73 171.44 11.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.77 0.319 . . . . 0.0 110.841 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.583 ' HA ' HD11 ' A' ' 66' ' ' LEU . 2.3 t60 -60.33 -29.88 69.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.961 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 37.6 m -81.37 -24.99 36.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.008 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.19 -72.04 0.46 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.998 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.885 HD13 HD12 ' A' ' 66' ' ' LEU . 3.6 mp -63.24 -38.96 93.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.912 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.196 -0.907 . . . . 0.0 110.892 -179.956 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 ttp . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.734 0.302 . . . . 0.0 111.468 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.3 mt -123.59 174.34 7.49 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.997 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.0 tmmm? -71.74 152.11 43.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.867 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.525 HD11 HD11 ' A' ' 78' ' ' LEU . 2.3 tt -122.01 143.52 49.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.931 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.54 ' HB2' HG22 ' A' ' 77' ' ' ILE . 8.1 t30 -128.62 -175.76 3.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.898 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.401 HD11 HH22 ' A' ' 35' ' ' ARG . 2.7 mp -144.43 128.51 17.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.973 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.87 -175.24 2.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.909 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.22 -38.1 43.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.908 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.2 m -68.17 -41.08 82.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.915 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.419 ' CZ ' HD13 ' A' ' 78' ' ' LEU . 20.7 t80 -58.86 -30.46 67.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.938 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -62.86 -46.47 87.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.954 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.565 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 1.2 mmmm -81.92 -20.47 38.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.004 0.43 . . . . 0.0 111.185 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.404 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 20.1 m-20 -90.45 -10.94 41.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.082 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.702 ' O ' HD13 ' A' ' 18' ' ' LEU . 27.7 t80 -90.59 -69.0 0.75 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.875 0.369 . . . . 0.0 111.117 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.775 ' HA ' HD22 ' A' ' 18' ' ' LEU . 2.0 t70 -91.15 -32.71 15.72 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.565 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -76.08 -25.81 55.88 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 120.706 -0.398 . . . . 0.0 111.444 -178.99 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.439 ' O ' ' HB3' ' A' ' 22' ' ' PHE . 0.6 OUTLIER -75.64 -33.23 60.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.017 0.437 . . . . 0.0 110.037 179.182 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.775 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.2 OUTLIER -55.63 -42.55 75.13 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.85 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.542 ' C ' HD12 ' A' ' 19' ' ' LEU . 4.5 pp -83.99 -0.86 53.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.479 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.01 36.24 1.59 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.883 0.373 . . . . 0.0 110.94 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.18 25.8 46.83 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.397 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.441 ' CD1' HD12 ' A' ' 18' ' ' LEU . 11.5 t80 -114.08 130.47 56.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.722 0.296 . . . . 0.0 110.806 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.62 ' HB3' HG23 ' A' ' 26' ' ' VAL . 4.8 t70 -72.71 116.11 12.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.951 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.809 ' HA ' HD23 ' A' ' 27' ' ' LEU . 20.1 p-10 -68.33 -25.07 64.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.14 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.7 m -64.71 -21.15 66.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.296 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.62 HG23 ' HB3' ' A' ' 23' ' ' ASP . 21.8 t -83.93 -40.42 15.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.474 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.809 HD23 ' HA ' ' A' ' 24' ' ' ASP . 1.2 pp -57.78 -36.1 71.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.804 0.335 . . . . 0.0 111.129 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.694 ' O ' HD12 ' A' ' 32' ' ' LEU . 15.1 t-20 -57.36 -20.6 30.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.418 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -84.55 -37.49 21.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.693 0.282 . . . . 0.0 111.34 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.906 HG23 HG21 ' A' ' 61' ' ' ILE . 8.0 p -90.41 -36.62 8.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.849 -179.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.712 HD12 HG13 ' A' ' 30' ' ' VAL . 1.4 mp -71.13 -50.03 44.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.588 -179.262 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.93 HD13 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -57.91 -18.92 26.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.549 0.214 . . . . 0.0 111.462 -179.454 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.93 ' N ' HD13 ' A' ' 32' ' ' LEU . 85.1 m -84.75 -30.85 24.35 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.9 0.381 . . . . 0.0 110.703 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.795 HD21 HD21 ' A' ' 40' ' ' LEU . 66.0 mt -89.55 -30.73 18.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.444 -179.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.401 HH22 HD11 ' A' ' 6' ' ' LEU . 13.4 mtt-85 -93.55 20.18 7.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.774 -179.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.443 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 24.4 mttm -119.47 -55.45 2.12 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.576 0.227 . . . . 0.0 111.024 179.791 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.443 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 159.62 -20.65 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.199 179.751 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -65.89 111.24 5.92 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.028 -179.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.95 -179.97 3.87 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.48 2.12 . . . . 0.0 112.2 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.795 HD21 HD21 ' A' ' 34' ' ' LEU . 44.1 mt -102.44 117.45 34.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.9 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -61.45 157.04 48.77 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.042 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -69.03 -10.28 28.71 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.582 2.188 . . . . 0.0 112.548 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.87 11.19 18.66 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.31 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.443 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.4 m-85 -88.48 5.25 43.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.26 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 63.48 36.73 11.06 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.852 0.358 . . . . 0.0 110.897 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -80.65 110.37 16.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.902 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -148.56 174.76 11.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.846 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -92.44 128.26 38.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.088 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.776 HD11 ' CD ' ' A' ' 58' ' ' GLU . 24.7 mt -78.66 -167.9 1.23 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.847 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.2 mmtm -130.26 164.53 24.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.85 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 79.44 -122.78 5.89 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.456 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.32 -30.23 64.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.842 0.353 . . . . 0.0 110.831 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.469 ' HB3' HD12 ' A' ' 49' ' ' LEU . 33.1 m95 -98.45 27.35 4.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.928 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.517 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -75.94 -50.45 3.14 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.775 -179.678 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.517 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 53.0 Cg_endo -70.75 -3.26 12.31 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.165 1.91 . . . . 0.0 112.905 -179.564 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.431 ' CE2' ' HG2' ' A' ' 55' ' ' PRO . 39.3 m-85 -114.35 167.39 10.75 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.834 0.35 . . . . 0.0 110.749 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 11.1 ttm180 -117.03 141.54 48.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.046 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.776 ' CD ' HD11 ' A' ' 49' ' ' LEU . 1.0 OUTLIER -98.09 171.72 8.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.017 -179.835 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.79 ' SG ' HD13 ' A' ' 40' ' ' LEU . 5.8 t -169.94 122.09 0.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.776 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.434 ' CD2' HD22 ' A' ' 66' ' ' LEU . 23.3 m170 -101.72 87.31 3.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.082 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.906 HG21 HG23 ' A' ' 30' ' ' VAL . 3.5 mp -64.38 -51.2 71.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.871 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.562 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 16.7 mmmt -118.32 167.7 10.96 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.205 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.562 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 55.9 Cg_endo -70.86 1.75 4.84 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.081 1.854 . . . . 0.0 112.899 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -142.17 25.02 1.94 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.778 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.808 ' O ' HD23 ' A' ' 66' ' ' LEU . 44.1 t -140.17 149.75 21.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.177 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.808 HD23 ' O ' ' A' ' 65' ' ' VAL . 5.8 mt -146.41 101.84 3.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.878 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.633 ' HB3' HD11 ' A' ' 61' ' ' ILE . 3.4 tm? -95.09 131.97 40.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.953 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.67 HG22 ' OE1' ' A' ' 58' ' ' GLU . 81.8 t -107.24 110.95 33.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.362 179.107 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.722 ' CE1' HD11 ' A' ' 76' ' ' LEU . 26.9 p90 -124.81 162.65 23.85 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.101 -179.36 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.787 ' HB2' HD11 ' A' ' 77' ' ' ILE . 1.5 tp -118.46 133.36 55.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.867 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.511 HG22 ' N ' ' A' ' 72' ' ' LYS . 7.2 p -74.47 158.52 5.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.046 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.511 ' N ' HG22 ' A' ' 71' ' ' VAL . 1.3 tptt -159.35 171.57 19.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.834 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -59.53 100.09 0.07 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.986 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 52.83 23.94 3.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.238 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -148.88 147.05 28.23 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.833 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.722 HD11 ' CE1' ' A' ' 69' ' ' TYR . 0.5 OUTLIER -121.05 151.59 39.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.92 179.915 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.787 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.2 pp -133.42 130.91 57.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.269 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.525 HD11 HD11 ' A' ' 4' ' ' LEU . 67.7 mt -80.26 124.75 29.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.785 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.42 ' HG ' ' CD1' ' A' ' 56' ' ' PHE . 0.1 OUTLIER -87.24 -62.79 1.42 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.914 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.78 162.74 16.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.933 0.397 . . . . 0.0 111.214 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.883 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.0 tm? -104.56 143.11 33.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.817 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.883 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -147.1 177.5 25.35 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.451 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.3 m -143.05 171.66 13.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.854 0.359 . . . . 0.0 110.984 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -60.55 -29.23 69.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.93 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.4 t -88.89 -25.23 22.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.042 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.7 -68.2 0.72 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.962 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.401 HD12 ' CD1' ' A' ' 66' ' ' LEU . 22.8 mt -70.14 -39.14 75.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.051 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.312 -0.851 . . . . 0.0 110.873 -179.996 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mtm . . . . . 0 N--CA 1.489 1.49 0 CA-C-O 120.8 0.333 . . . . 0.0 111.079 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 60.84 169.73 0.09 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.022 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.66 151.75 19.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.818 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.773 HD11 HD11 ' A' ' 78' ' ' LEU . 1.1 tt -116.01 143.73 45.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.979 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.797 ' HB2' HG22 ' A' ' 77' ' ' ILE . 0.9 OUTLIER -123.6 -177.52 3.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.863 179.97 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -142.1 118.31 10.75 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.837 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -95.47 174.08 7.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.859 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 44.5 mttt -74.21 -41.84 60.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.825 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.1 p -66.66 -31.32 71.92 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.812 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -75.0 -33.86 61.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.833 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -65.0 -38.64 91.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.806 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.569 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 8.9 pttt -81.65 -25.83 35.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.094 0.473 . . . . 0.0 110.994 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.486 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 6.7 m-20 -90.66 -13.45 34.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.068 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.531 ' O ' HD21 ' A' ' 18' ' ' LEU . 20.5 t80 -91.7 -62.04 1.51 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.105 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.09 -43.67 9.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.287 -179.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.569 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 28.5 mttm -73.31 -17.08 61.35 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 120.908 -0.317 . . . . 0.0 111.477 -178.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.486 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 21.5 tp -76.79 -37.82 55.11 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.487 -0.561 . . . . 0.0 109.487 179.188 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.83 HD13 ' CB ' ' A' ' 24' ' ' ASP . 0.4 OUTLIER -67.16 -33.08 74.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.853 179.85 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.0 mt -74.9 -35.55 62.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.84 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.39 -22.69 67.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.099 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 133.09 41.03 0.19 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.463 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.405 ' CB ' ' HG ' ' A' ' 17' ' ' LEU . 32.6 t80 -124.04 144.31 49.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.868 0.366 . . . . 0.0 110.861 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.606 ' HB3' HG12 ' A' ' 26' ' ' VAL . 5.0 t0 -69.24 122.55 19.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.017 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.83 ' CB ' HD13 ' A' ' 18' ' ' LEU . 28.4 p-10 -78.94 -27.63 43.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.201 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.8 -56.15 13.46 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.399 -179.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.606 HG12 ' HB3' ' A' ' 23' ' ' ASP . 14.5 p -49.37 -28.48 3.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.629 -179.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.664 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -72.88 -33.26 65.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.9 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -55.28 -50.72 68.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.002 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -59.17 -23.92 62.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.094 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.527 ' CG1' HD13 ' A' ' 61' ' ' ILE . 91.1 t -77.72 -72.2 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.105 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.405 HG23 ' HG3' ' A' ' 35' ' ' ARG . 1.5 mp -49.37 -27.48 2.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.229 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.64 HD23 ' N ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -67.68 -36.4 80.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.858 179.852 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.64 ' N ' HD23 ' A' ' 32' ' ' LEU . 61.9 m -70.59 -27.62 64.24 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.497 -179.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.435 ' CD2' HD11 ' A' ' 40' ' ' LEU . 21.3 mt -90.26 -29.51 18.11 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.669 -179.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.577 ' HD2' HD13 ' A' ' 4' ' ' LEU . 10.8 mtp180 -97.09 20.21 11.67 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -179.275 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.495 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.5 OUTLIER -121.38 -55.83 1.92 Allowed 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 121.022 -0.271 . . . . 0.0 111.086 179.746 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.495 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 6.1 pttm 152.04 -20.44 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.036 0.534 . . . . 0.0 110.949 179.605 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.528 ' HB3' HG23 ' A' ' 33' ' ' THR . 1.3 tt0 -63.56 114.79 14.34 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.993 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.53 -179.67 4.32 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.416 2.078 . . . . 0.0 112.146 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.75 HD22 ' SG ' ' A' ' 59' ' ' CYS . 5.5 mp -108.33 142.71 38.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.962 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.06 157.88 74.23 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.107 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.66 -10.02 25.92 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.612 2.208 . . . . 0.0 112.663 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.19 20.6 8.96 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.142 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.538 ' HD2' HD23 ' A' ' 40' ' ' LEU . 8.4 m-30 -104.14 8.48 36.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.218 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 59.42 37.26 23.21 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.875 0.369 . . . . 0.0 110.878 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.3 p-10 -79.26 104.26 9.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.874 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -169.18 176.94 5.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.876 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.31 148.16 48.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.001 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.54 HD21 ' CD ' ' A' ' 58' ' ' GLU . 4.2 mt -96.85 178.78 5.18 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.825 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 11.6 ptpt -112.88 179.27 4.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.986 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 67.1 -145.17 45.94 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.601 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 9.4 mmtm -59.94 -20.45 57.52 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.638 0.256 . . . . 0.0 111.105 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 8.7 m95 -96.81 39.28 1.18 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.992 0.425 . . . . 0.0 110.827 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.44 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.8 OUTLIER -70.19 -49.14 18.66 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.426 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.44 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 86.2 Cg_endo -83.1 37.64 0.68 Allowed 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.572 2.181 . . . . 0.0 113.031 -179.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.492 ' CE1' HD21 ' A' ' 79' ' ' LEU . 20.9 m-85 -136.4 172.65 12.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.698 179.651 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 27.0 ttm105 -136.14 135.17 39.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.844 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.54 ' CD ' HD21 ' A' ' 49' ' ' LEU . 1.4 tt0 -96.0 167.63 11.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.892 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.75 ' SG ' HD22 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -166.56 111.93 0.8 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.807 179.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.405 ' N ' ' CD2' ' A' ' 60' ' ' HIS . 12.1 m170 -91.29 85.15 5.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.003 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.666 HG13 HD21 ' A' ' 40' ' ' LEU . 3.8 mp -58.51 -29.66 39.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.013 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.41 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 29.2 mttt -139.71 162.81 48.9 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.604 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.41 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 31.3 Cg_endo -63.71 -8.12 14.64 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.312 2.008 . . . . 0.0 112.77 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -133.3 26.52 4.15 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.591 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.878 ' O ' HD23 ' A' ' 66' ' ' LEU . 60.6 t -142.72 145.44 23.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.168 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.878 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.2 OUTLIER -148.46 97.76 2.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.646 179.707 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.762 HD22 ' N ' ' A' ' 68' ' ' VAL . 1.4 tm? -91.79 135.4 33.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.01 0.434 . . . . 0.0 111.1 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.762 ' N ' HD22 ' A' ' 67' ' ' LEU . 97.7 t -108.1 124.89 64.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.889 178.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.9 ' CD1' HD11 ' A' ' 76' ' ' LEU . 13.6 p90 -137.27 153.78 50.26 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.224 -179.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.719 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.9 OUTLIER -112.55 131.9 55.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.946 -179.997 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.523 HG22 ' N ' ' A' ' 72' ' ' LYS . 8.1 p -78.79 159.67 4.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.062 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.523 ' N ' HG22 ' A' ' 71' ' ' VAL . 3.6 tmtm? -143.66 160.61 40.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.864 179.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -40.27 -32.96 0.21 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.773 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.7 p-10 -164.93 30.97 0.06 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.922 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 71.7 mt-10 -153.35 158.34 41.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.868 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.9 HD11 ' CD1' ' A' ' 69' ' ' TYR . 6.0 tp -123.14 137.47 54.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.416 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.797 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.0 pp -127.42 134.67 65.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.424 -179.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.773 HD11 HD11 ' A' ' 4' ' ' LEU . 28.2 mt -86.99 124.75 33.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.858 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.519 HD11 ' HB2' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -82.43 -64.74 1.11 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.824 179.96 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.467 ' O ' HD22 ' A' ' 67' ' ' LEU . 0.4 OUTLIER -162.33 171.21 17.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.085 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.699 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.5 tm? -126.26 132.05 51.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.946 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.699 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -143.59 165.46 27.16 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.467 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 17.3 m -104.79 173.95 6.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.724 0.297 . . . . 0.0 110.983 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -64.36 -24.52 67.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.06 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 73.4 m -89.98 -26.83 20.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.08 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -73.91 -68.18 0.54 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.041 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.508 HD12 HD12 ' A' ' 66' ' ' LEU . 17.3 mt -72.15 -32.11 66.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.018 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.899 179.918 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mtm . . . . . 0 N--CA 1.487 1.425 0 N-CA-C 111.614 0.228 . . . . 0.0 111.614 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 mp 57.05 176.42 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.907 0.384 . . . . 0.0 111.007 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.55 172.07 8.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.77 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.9 tt -137.27 153.98 50.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.899 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.76 ' HB2' HG22 ' A' ' 77' ' ' ILE . 2.6 t30 -146.48 176.31 9.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.917 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.3 mt -137.74 131.24 31.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.867 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -103.28 166.06 10.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.915 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.63 -30.88 69.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.886 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.1 m -76.55 -41.73 45.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.863 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.589 ' HE2' HD13 ' A' ' 67' ' ' LEU . 22.5 t80 -71.45 -34.88 70.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.87 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -59.85 -40.71 89.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.802 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.546 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -89.98 -15.31 32.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.276 -179.959 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.457 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 5.0 m-20 -90.36 -11.12 41.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.185 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.697 ' O ' HD13 ' A' ' 18' ' ' LEU . 17.2 t80 -90.74 -67.08 0.87 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.978 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.843 ' HA ' HD22 ' A' ' 18' ' ' LEU . 2.3 m-20 -90.95 -34.37 15.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.163 -179.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.546 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -76.44 -19.42 58.08 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.508 -179.127 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.457 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 36.5 tp -82.47 -34.25 28.15 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.843 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.1 OUTLIER -50.98 -48.69 61.14 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.905 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 27.7 mt -90.16 12.86 16.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.467 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -111.09 31.65 5.89 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.878 0.371 . . . . 0.0 110.86 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.01 22.83 22.0 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.473 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.496 ' CD1' HD12 ' A' ' 18' ' ' LEU . 29.4 t80 -117.08 143.91 45.25 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.81 0.338 . . . . 0.0 110.851 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.567 ' HB3' HG23 ' A' ' 26' ' ' VAL . 3.9 t70 -91.92 111.05 22.43 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.856 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.834 ' HA ' HD23 ' A' ' 27' ' ' LEU . 36.2 p-10 -53.89 -27.31 29.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.202 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.8 t -60.73 -19.39 58.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.246 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.567 HG23 ' HB3' ' A' ' 23' ' ' ASP . 21.8 t -88.55 -40.7 13.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.691 0.281 . . . . 0.0 111.486 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.834 HD23 ' HA ' ' A' ' 24' ' ' ASP . 1.2 pp -57.65 -36.48 71.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.118 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -62.78 -28.01 69.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.009 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -75.06 -34.2 61.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.186 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 1.101 HG23 HG21 ' A' ' 61' ' ' ILE . 10.9 p -89.96 -47.29 14.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.395 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.578 HD12 HG13 ' A' ' 30' ' ' VAL . 1.6 mp -58.05 -25.14 25.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.86 0.362 . . . . 0.0 110.707 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.867 HD23 ' N ' ' A' ' 33' ' ' THR . 0.2 OUTLIER -70.52 -52.5 21.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.27 -179.721 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.867 ' N ' HD23 ' A' ' 32' ' ' LEU . 89.3 m -66.56 -23.97 66.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.918 -179.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.579 HD21 HD21 ' A' ' 40' ' ' LEU . 76.2 mt -89.95 -33.61 16.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.756 0.312 . . . . 0.0 111.591 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.1 mtt180 -98.81 20.22 13.48 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -179.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.51 ' O ' ' HB3' ' A' ' 37' ' ' LYS . 4.0 mtmt -108.69 -55.88 2.34 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.033 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.51 ' HB3' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 150.83 -20.38 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.122 0.569 . . . . 0.0 110.801 179.622 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.62 126.36 89.48 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.605 -0.27 . . . . 0.0 110.987 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -75.08 169.41 22.65 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.449 2.099 . . . . 0.0 112.278 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.579 HD21 HD21 ' A' ' 34' ' ' LEU . 4.6 mt -95.82 126.09 40.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.802 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.407 ' HB2' ' CE1' ' A' ' 44' ' ' PHE . 5.4 m-20 -72.26 162.16 75.21 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.055 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -68.89 -27.54 30.65 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.609 2.206 . . . . 0.0 112.304 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -64.76 -15.54 61.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.326 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.407 ' CE1' ' HB2' ' A' ' 41' ' ' ASP . 24.6 m-85 -79.17 -0.19 30.85 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.57 -0.287 . . . . 0.0 111.552 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 67.83 48.56 1.01 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.959 0.409 . . . . 0.0 110.843 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.2 p-10 -88.92 89.02 7.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.772 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.405 ' HA ' ' NH1' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -151.48 -179.88 7.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.044 -179.796 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -84.46 125.08 32.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.112 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 90.0 mt -72.3 -178.57 2.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.898 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -110.15 172.75 6.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.928 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 78.21 -117.96 4.8 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.587 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.2 mttm -89.63 -18.03 27.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.578 0.228 . . . . 0.0 111.298 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 16.5 m-90 -96.18 38.26 1.2 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.805 0.336 . . . . 0.0 111.083 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.435 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 5.0 mtpt -83.96 -50.92 0.62 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.042 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 17.0 Cg_exo -66.62 -8.84 22.29 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.505 2.137 . . . . 0.0 112.475 179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.599 ' HA ' HD12 ' A' ' 70' ' ' LEU . 13.1 m-85 -105.75 -171.64 1.94 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.904 0.383 . . . . 0.0 111.066 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.405 ' NH1' ' HA ' ' A' ' 47' ' ' HIS . 4.1 ttm-85 -138.92 136.22 35.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.847 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.454 ' OE2' HD22 ' A' ' 87' ' ' LEU . 6.9 tp10 -106.19 162.79 13.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.114 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.559 ' SG ' HD13 ' A' ' 40' ' ' LEU . 3.1 t -162.71 117.45 1.78 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.906 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -90.28 89.47 7.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.932 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 1.101 HG21 HG23 ' A' ' 30' ' ' VAL . 4.0 mp -60.53 -31.4 48.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.069 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.5 mttm -141.42 172.86 5.45 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.765 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -66.78 -6.35 15.42 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.706 2.27 . . . . 0.0 112.663 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -142.27 26.09 1.84 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.879 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.616 ' C ' HD23 ' A' ' 66' ' ' LEU . 64.5 t -141.06 140.85 32.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.184 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.616 HD23 ' C ' ' A' ' 65' ' ' VAL . 0.0 OUTLIER -159.14 110.3 2.06 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.759 179.863 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.589 HD13 ' HE2' ' A' ' 10' ' ' PHE . 0.2 OUTLIER -108.3 131.8 54.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.712 -179.973 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.448 ' O ' HD12 ' A' ' 67' ' ' LEU . 41.5 t -88.68 140.45 15.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.98 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.414 ' CE2' ' HB2' ' A' ' 59' ' ' CYS . 2.6 p90 -146.77 159.36 43.6 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.918 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.778 ' HB2' HD11 ' A' ' 77' ' ' ILE . 2.8 tp -109.24 171.98 7.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.856 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 28.7 t -123.26 103.71 13.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.181 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.06 168.37 10.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.743 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -58.76 104.04 0.2 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.832 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 57.0 22.05 6.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.122 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -148.68 138.21 21.95 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.748 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.7 tp -108.03 143.93 36.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.933 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.778 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.2 pp -131.64 130.26 62.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.201 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.403 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 74.9 mt -76.28 135.4 39.62 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.747 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.36 -62.68 1.29 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.137 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.69 164.59 18.99 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.931 0.396 . . . . 0.0 111.472 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.612 ' C ' HD13 ' A' ' 81' ' ' LEU . 3.1 tm? -125.19 126.73 45.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.598 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.447 ' HA3' HD11 ' A' ' 87' ' ' LEU . . . -146.31 -174.9 18.86 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.557 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 22.7 m -110.55 174.46 5.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.91 0.386 . . . . 0.0 111.031 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.33 -25.3 65.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.981 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 69.6 m -86.93 -15.97 37.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.281 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -86.79 -69.28 0.69 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.02 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.464 ' H ' HD12 ' A' ' 87' ' ' LEU . 6.5 mp -63.15 -41.23 99.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.079 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.208 -0.901 . . . . 0.0 110.958 179.961 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.3 mtp . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.804 0.335 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.89 HD13 ' HB2' ' A' ' 76' ' ' LEU . 0.6 OUTLIER -153.73 152.6 30.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.917 179.978 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.9 151.32 47.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.892 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.2 tt -121.21 154.38 36.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.83 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.715 ' HB2' HG22 ' A' ' 77' ' ' ILE . 0.7 OUTLIER -147.54 155.81 42.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.901 179.978 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.9 mp -124.78 126.78 46.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.976 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -100.52 158.97 15.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.957 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.3 tttm -61.26 -31.74 71.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.899 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 6.6 m -66.1 -28.96 69.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.032 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.692 ' HE1' HD13 ' A' ' 67' ' ' LEU . 55.7 t80 -73.87 -32.4 63.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.134 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -79.29 -30.08 42.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.056 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.03 -16.2 30.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.387 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -81.74 -30.48 32.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.639 0.257 . . . . 0.0 111.148 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.887 ' CE2' HD13 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -90.42 -53.02 4.62 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 179.538 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.604 ' HA ' HD22 ' A' ' 18' ' ' LEU . 11.9 m-20 -51.48 -34.47 35.84 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.06 0.457 . . . . 0.0 110.074 178.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.54 -27.98 37.42 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.097 179.044 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.2 mt -76.12 -41.5 49.92 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.1 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.604 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.0 OUTLIER -54.13 -33.18 57.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.992 179.914 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 mt -90.06 -5.86 56.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.617 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.64 38.01 1.24 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.846 0.355 . . . . 0.0 111.068 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.67 26.71 41.27 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.502 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.516 ' CD1' HD12 ' A' ' 18' ' ' LEU . 10.6 t80 -119.51 128.39 53.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.814 0.34 . . . . 0.0 110.88 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.41 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 8.0 t70 -84.85 131.28 34.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.996 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.7 p-10 -56.9 -21.8 32.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.099 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.6 t -48.15 -53.45 16.69 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.821 0.343 . . . . 0.0 110.955 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.42 ' HB ' ' CZ ' ' A' ' 22' ' ' PHE . 39.2 t -65.14 -35.11 74.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.669 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.887 HD13 ' CE2' ' A' ' 14' ' ' PHE . 1.1 tp -59.14 -33.52 70.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.669 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -59.35 -47.09 86.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.912 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -63.14 -40.06 96.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.932 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 94.6 t -66.27 -72.46 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.09 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.796 HD13 ' CD1' ' A' ' 27' ' ' LEU . 1.2 mp -45.76 -33.45 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 121.152 0.501 . . . . 0.0 110.523 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.839 HD23 ' N ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -55.51 -59.97 4.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.17 179.35 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.839 ' N ' HD23 ' A' ' 32' ' ' LEU . 64.6 m -54.34 -24.45 19.39 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.307 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 31' ' ' ILE . 17.7 mt -73.36 -62.08 1.6 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.844 0.354 . . . . 0.0 110.961 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.4 mtp180 -67.9 -49.0 64.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.029 0.442 . . . . 0.0 110.921 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.617 ' HE2' HD21 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -68.55 -13.77 62.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.533 179.882 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.547 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 1.3 pttm 52.59 70.73 0.54 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.679 -179.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.699 ' HB3' HG23 ' A' ' 33' ' ' THR . 1.3 tm-20 -81.56 142.48 49.84 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.636 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -61.32 104.8 0.31 Allowed 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.366 2.044 . . . . 0.0 112.135 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.445 HD22 ' CD2' ' A' ' 44' ' ' PHE . 57.3 mt -68.3 137.61 54.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.99 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -87.29 158.42 52.19 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.82 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.32 -26.72 63.65 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.504 2.136 . . . . 0.0 112.224 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -67.68 -21.46 65.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.094 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.445 ' CD2' HD22 ' A' ' 40' ' ' LEU . 3.2 m-85 -56.5 -27.64 57.75 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.003 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 63.29 61.33 1.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.939 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.0 p-10 -91.45 77.35 5.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.871 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -125.89 -175.29 3.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.043 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.07 166.97 21.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.253 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.572 ' N ' HD12 ' A' ' 49' ' ' LEU . 1.0 OUTLIER -104.44 -167.55 1.37 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.885 179.883 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -126.1 151.38 47.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.864 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 92.12 -136.03 13.03 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.564 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.22 -11.81 61.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.614 0.245 . . . . 0.0 111.352 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 17.3 m-90 -96.69 39.33 1.17 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.969 0.414 . . . . 0.0 111.007 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.508 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 2.4 ttmm -72.71 -50.25 7.62 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.468 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.508 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 63.1 Cg_endo -74.43 0.43 8.61 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.336 2.024 . . . . 0.0 112.932 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.447 ' CD1' HD13 ' A' ' 70' ' ' LEU . 39.4 m-85 -102.83 179.78 4.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.808 0.337 . . . . 0.0 110.817 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.42 ' NH1' HG21 ' A' ' 71' ' ' VAL . 12.1 ttm180 -147.14 134.39 20.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.833 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.5 ' HG3' HG22 ' A' ' 68' ' ' VAL . 4.0 tt0 -95.85 162.93 13.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.002 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.433 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 21.6 t -163.87 105.91 0.93 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.847 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.434 ' CD2' ' N ' ' A' ' 60' ' ' HIS . 6.8 m170 -84.79 94.96 8.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.955 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.547 HD11 ' HB3' ' A' ' 67' ' ' LEU . 4.4 mp -66.09 -25.22 35.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.913 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.43 169.96 10.67 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.766 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -70.86 1.2 5.4 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.798 2.332 . . . . 0.0 112.866 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -144.38 24.06 1.6 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.845 0.355 . . . . 0.0 110.778 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.813 ' O ' HD23 ' A' ' 66' ' ' LEU . 41.4 t -136.49 153.13 30.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.919 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.813 HD23 ' O ' ' A' ' 65' ' ' VAL . 3.7 mt -145.56 112.27 5.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.775 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.742 HD12 ' N ' ' A' ' 68' ' ' VAL . 4.7 tp -106.66 128.74 54.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.018 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.742 ' N ' HD12 ' A' ' 67' ' ' LEU . 66.9 t -108.4 134.16 51.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.753 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.433 ' CE2' ' HB2' ' A' ' 59' ' ' CYS . 2.8 p90 -144.07 165.43 27.81 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.886 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.466 ' HB2' HD11 ' A' ' 77' ' ' ILE . 8.3 tp -100.24 157.53 16.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.871 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.42 HG21 ' NH1' ' A' ' 57' ' ' ARG . 21.4 t -113.31 103.82 16.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.116 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.9 tttp -83.17 161.74 21.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.719 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -44.02 -35.87 2.27 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.443 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.0 p-10 -156.0 29.66 0.36 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.82 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -152.5 156.6 39.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.814 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.89 ' HB2' HD13 ' A' ' 2' ' ' LEU . 11.8 tp -119.67 139.92 51.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.715 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.715 HG22 ' HB2' ' A' ' 5' ' ' ASN . 1.8 pp -133.35 127.95 54.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.212 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.43 HD22 HD21 ' A' ' 67' ' ' LEU . 58.9 mt -70.22 139.81 52.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.95 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.32 -73.72 0.65 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.058 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.08 174.61 13.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.875 0.369 . . . . 0.0 111.364 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.897 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.1 tm? -120.93 140.65 51.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.838 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.897 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -147.13 -176.85 21.2 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.572 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.1 t -139.81 -172.03 3.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.818 0.342 . . . . 0.0 110.912 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.8 t-160 -72.63 -28.66 62.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.965 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.01 -23.06 21.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.088 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -85.74 -71.12 0.55 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.874 0.368 . . . . 0.0 111.003 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.529 HD12 ' CD1' ' A' ' 66' ' ' LEU . 72.6 mt -60.45 -40.66 91.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.992 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.175 -0.917 . . . . 0.0 110.976 179.946 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mpp? . . . . . 0 N--CA 1.487 1.41 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.3 mt -90.65 161.28 15.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.897 0.38 . . . . 0.0 110.857 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.42 142.37 55.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.781 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.555 HD12 HD23 ' A' ' 76' ' ' LEU . 7.7 tp -114.03 154.45 27.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.013 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.719 ' HB2' HG22 ' A' ' 77' ' ' ILE . 2.0 t30 -138.9 176.04 9.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.832 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.0 mt -138.9 129.06 25.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.997 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 25.8 mmtm -97.21 -177.45 3.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.784 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.83 -33.85 39.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.924 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.6 m -74.59 -34.34 62.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.016 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.473 ' HE1' HD13 ' A' ' 67' ' ' LEU . 36.0 t80 -61.16 -29.22 69.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.075 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -71.55 -42.39 67.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.02 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.549 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 2.6 mtmm -78.54 -19.51 52.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.284 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.406 ' C ' ' HB2' ' A' ' 17' ' ' LEU . 20.7 m-20 -90.4 -10.39 44.05 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.095 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.536 ' O ' HD21 ' A' ' 18' ' ' LEU . 6.7 t80 -91.17 -66.03 0.96 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.801 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -91.46 -37.73 12.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.89 -0.595 . . . . 0.0 112.15 -179.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.549 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -75.49 -18.27 59.89 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 120.941 -0.304 . . . . 0.0 111.677 -178.799 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.43 HD11 ' HG3' ' A' ' 86' ' ' GLU . 1.2 tt -79.81 -34.1 39.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.977 0.418 . . . . 0.0 109.891 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.782 HD13 ' HB3' ' A' ' 24' ' ' ASP . 0.8 OUTLIER -66.65 -33.82 76.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.799 179.641 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.9 mt -80.57 -36.05 33.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.911 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -57.61 -22.73 47.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.086 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.98 36.7 0.27 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.687 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.406 ' CE2' ' O ' ' A' ' 23' ' ' ASP . 75.0 t80 -122.11 163.3 19.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.72 0.295 . . . . 0.0 110.951 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.406 ' O ' ' CE2' ' A' ' 22' ' ' PHE . 9.9 t70 -86.31 123.08 31.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.941 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.782 ' HB3' HD13 ' A' ' 18' ' ' LEU . 9.4 p-10 -77.85 -31.61 51.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.985 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.0 t -60.86 -40.79 94.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.35 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 45.3 t -58.66 -37.99 68.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.341 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.562 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.6 OUTLIER -60.83 -33.58 73.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.975 -179.885 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.412 ' N ' ' HG ' ' A' ' 27' ' ' LEU . 5.6 t30 -58.36 -29.0 65.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.122 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -72.04 -44.39 63.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.031 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.645 HG13 HD12 ' A' ' 31' ' ' ILE . 10.8 p -80.13 -46.15 22.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.148 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.645 HD12 HG13 ' A' ' 30' ' ' VAL . 1.6 mp -58.42 -29.96 39.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.921 0.391 . . . . 0.0 110.657 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.448 ' C ' HD23 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -67.1 -24.7 65.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.166 -179.791 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 51.4 m -90.21 -24.0 21.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.568 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.0 mt -90.11 -38.8 13.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.593 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.566 ' CD ' HG23 ' A' ' 31' ' ' ILE . 51.9 mtp85 -90.56 20.15 4.81 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -179.292 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.479 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 2.2 mttm -110.98 -55.76 2.45 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 121.106 -0.238 . . . . 0.0 111.012 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.479 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 155.65 -20.5 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.109 179.669 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -78.24 113.05 30.31 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.152 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -74.58 -179.55 4.95 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.545 2.163 . . . . 0.0 112.108 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.47 HD13 ' SG ' ' A' ' 59' ' ' CYS . 15.6 mt -87.78 116.1 25.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.822 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -60.9 159.38 27.21 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.999 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.46 -9.34 25.03 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.602 2.201 . . . . 0.0 112.574 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.14 8.95 24.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.293 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -92.39 11.7 25.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.658 0.266 . . . . 0.0 111.294 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 60.93 32.05 19.98 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.803 0.335 . . . . 0.0 110.984 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -69.26 98.61 1.06 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.81 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 32.5 m80 -144.27 177.17 8.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.888 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.53 129.82 34.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.135 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.401 HD11 ' HG3' ' A' ' 58' ' ' GLU . 21.8 mt -72.63 -178.93 2.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.868 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.3 mtmt -120.36 169.72 10.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.924 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 79.12 -118.25 4.74 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.492 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.53 -21.75 30.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.663 0.268 . . . . 0.0 111.221 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 6.2 m95 -96.27 38.71 1.18 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.848 0.356 . . . . 0.0 110.885 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.438 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 11.6 ttmt -73.77 -51.29 5.26 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.237 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.438 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 89.2 Cg_endo -79.77 47.1 2.41 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.307 2.005 . . . . 0.0 112.481 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.419 ' HA ' HD11 ' A' ' 70' ' ' LEU . 96.7 m-85 -157.65 175.92 13.29 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.868 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.568 ' O ' HG13 ' A' ' 68' ' ' VAL . 4.3 ttm180 -130.96 134.39 46.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.853 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.401 ' HG3' HD11 ' A' ' 49' ' ' LEU . 2.6 tm-20 -104.83 167.64 9.59 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.982 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.47 ' SG ' HD13 ' A' ' 40' ' ' LEU . 6.3 t -171.1 115.4 0.42 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.659 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.418 ' O ' ' CG ' ' A' ' 60' ' ' HIS . 12.2 p80 -93.33 109.55 21.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.058 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.49 HD12 ' N ' ' A' ' 61' ' ' ILE . 4.3 mp -77.92 -27.68 15.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.754 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.43 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 12.6 mtpp -133.18 168.94 15.4 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.6 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.43 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 14.8 Cg_exo -68.72 -0.3 5.89 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.634 2.222 . . . . 0.0 113.015 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -144.47 27.61 1.37 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.811 0.338 . . . . 0.0 110.801 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.809 ' O ' HD23 ' A' ' 66' ' ' LEU . 48.3 t -136.38 148.72 27.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.037 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.809 HD23 ' O ' ' A' ' 65' ' ' VAL . 2.0 mt -147.06 93.24 2.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.78 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.622 HD12 ' N ' ' A' ' 68' ' ' VAL . 3.2 tp -93.81 120.45 34.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.85 -179.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.622 ' N ' HD12 ' A' ' 67' ' ' LEU . 47.7 t -94.32 135.35 28.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.04 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.879 ' CD1' HD11 ' A' ' 76' ' ' LEU . 29.6 p90 -147.36 168.2 22.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.101 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.741 ' HB2' HD11 ' A' ' 77' ' ' ILE . 1.6 tp -122.18 143.36 49.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.694 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -102.07 99.15 7.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.246 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.416 ' O ' ' C ' ' A' ' 73' ' ' ASP . 0.0 OUTLIER -77.44 167.09 22.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.72 179.883 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.416 ' C ' ' O ' ' A' ' 72' ' ' LYS . 1.2 p30 -30.04 -60.75 0.17 Allowed 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.196 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -143.67 30.82 1.33 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.789 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -154.51 109.44 3.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.194 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.879 HD11 ' CD1' ' A' ' 69' ' ' TYR . 1.6 tp -70.32 141.82 52.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.79 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.741 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.1 pp -129.8 136.54 58.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.321 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.465 HD11 HD21 ' A' ' 4' ' ' LEU . 82.0 mt -79.41 137.88 37.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.835 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.438 HD12 ' HD2' ' A' ' 80' ' ' ARG . 0.2 OUTLIER -96.92 -72.8 0.63 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.959 179.968 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.438 ' HD2' HD12 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -158.16 174.01 15.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.191 179.953 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.607 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.3 tm? -120.04 131.76 55.23 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.746 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.607 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -145.4 -174.82 17.97 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.545 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 20.0 m -152.55 -173.31 4.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.905 0.383 . . . . 0.0 110.805 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 -65.72 -30.57 71.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.854 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 55.9 m -89.91 -30.27 17.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.94 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.43 ' HG3' HD11 ' A' ' 17' ' ' LEU . 1.9 mm-40 -74.77 -73.39 0.24 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.943 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.426 HD12 HD12 ' A' ' 66' ' ' LEU . 33.9 mt -65.64 -34.19 77.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.842 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.946 179.983 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 ptm . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.783 0.325 . . . . 0.0 111.268 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 20.0 mt 59.87 160.96 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.935 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.45 151.48 20.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.815 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.1 tp -116.49 148.75 40.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.852 0.358 . . . . 0.0 111.051 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.496 ' HB2' HG22 ' A' ' 77' ' ' ILE . 5.9 t30 -140.67 -179.13 5.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.823 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.429 HD21 ' NH2' ' A' ' 35' ' ' ARG . 3.1 mp -144.62 143.69 30.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.929 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.6 mmtt -114.88 -177.92 3.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.906 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.46 -31.46 67.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.812 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.84 -33.59 68.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.928 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.484 ' CZ ' HD13 ' A' ' 78' ' ' LEU . 41.1 t80 -80.06 -32.13 39.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.938 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -59.94 -38.56 82.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.906 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.558 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 2.7 pttp -86.27 -22.68 26.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.165 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -90.7 -10.43 43.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.241 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.701 ' O ' HD13 ' A' ' 18' ' ' LEU . 93.9 t80 -90.58 -67.46 0.85 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.16 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.827 ' HA ' HD22 ' A' ' 18' ' ' LEU . 0.5 OUTLIER -91.0 -31.46 16.31 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -179.21 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.558 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -77.91 -26.52 49.1 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.482 -179.07 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.54 -31.34 60.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.92 0.39 . . . . 0.0 110.17 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.827 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.2 OUTLIER -55.68 -43.3 76.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.045 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.455 ' O ' HD12 ' A' ' 19' ' ' LEU . 4.0 pp -90.11 15.02 10.95 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.494 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -113.64 33.1 5.36 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.795 0.331 . . . . 0.0 110.813 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.55 27.08 23.38 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.304 -179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.455 ' CD1' ' N ' ' A' ' 23' ' ' ASP . 14.3 t80 -115.2 149.7 37.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.83 0.348 . . . . 0.0 110.824 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.455 ' N ' ' CD1' ' A' ' 22' ' ' PHE . 46.2 t0 -92.52 98.75 11.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.91 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -54.06 -30.21 47.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.244 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.4 m -58.88 -26.22 64.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.161 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.47 ' O ' HG23 ' A' ' 30' ' ' VAL . 38.3 t -84.6 -36.47 11.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.299 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.579 ' CD2' HD21 ' A' ' 18' ' ' LEU . 0.2 OUTLIER -55.53 -35.8 66.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.85 -179.925 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.448 ' O ' ' HB3' ' A' ' 32' ' ' LEU . 8.7 t-20 -53.41 -66.09 0.45 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.172 -179.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -46.9 -28.57 1.64 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.484 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 26' ' ' VAL . 37.9 t -75.37 -69.59 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.306 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.1 mp -55.97 -24.38 17.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.082 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.487 ' C ' HD23 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -71.23 -21.17 62.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.97 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.6 m -90.0 -33.55 16.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.881 0.372 . . . . 0.0 111.464 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.774 HD21 HD21 ' A' ' 40' ' ' LEU . 14.1 mt -90.17 -26.33 20.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.786 -179.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.429 ' NH2' HD21 ' A' ' 6' ' ' LEU . 26.6 mtt180 -99.01 20.29 13.57 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -179.138 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.459 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 2.7 mtmt -116.47 -55.63 2.36 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.92 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.459 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 157.45 -20.55 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.161 179.665 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -63.84 110.64 4.01 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.069 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.43 166.89 25.65 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.399 2.066 . . . . 0.0 112.235 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.774 HD21 HD21 ' A' ' 34' ' ' LEU . 8.5 mt -94.71 123.25 38.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.977 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -68.2 156.86 89.06 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.934 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.33 -8.8 24.48 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.678 2.252 . . . . 0.0 112.512 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -89.48 12.01 17.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.395 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -98.89 14.23 29.74 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.711 0.291 . . . . 0.0 111.249 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 56.02 36.08 26.72 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.856 0.36 . . . . 0.0 111.064 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -82.56 90.45 6.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.902 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -138.62 -178.38 5.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.873 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.36 142.03 32.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.213 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.655 HD12 ' HB3' ' A' ' 53' ' ' TRP . 15.3 mt -83.62 -172.25 4.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.798 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.8 mmtt -116.57 163.12 16.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.975 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.82 -136.07 18.2 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.52 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.5 mmpt? -67.22 -18.24 65.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.566 0.222 . . . . 0.0 111.225 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.655 ' HB3' HD12 ' A' ' 49' ' ' LEU . 5.3 m-90 -96.45 31.93 2.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.741 0.305 . . . . 0.0 111.154 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 3.0 mttt -79.63 -51.38 1.19 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.911 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 23.7 Cg_exo -63.76 -11.81 28.46 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.514 2.143 . . . . 0.0 112.234 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.686 ' HD1' HD13 ' A' ' 70' ' ' LEU . 73.1 m-85 -105.17 171.87 7.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.813 0.339 . . . . 0.0 110.973 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.0 ttp85 -125.73 154.35 42.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.837 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.514 ' HB2' HD21 ' A' ' 49' ' ' LEU . 0.2 OUTLIER -117.79 162.22 18.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.054 -179.969 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.633 ' SG ' HD13 ' A' ' 40' ' ' LEU . 38.0 t -150.65 145.33 25.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.803 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.448 ' CE1' HD22 ' A' ' 66' ' ' LEU . 9.9 m170 -116.49 87.19 2.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.944 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.616 ' H ' HD12 ' A' ' 61' ' ' ILE . 5.3 mp -60.01 -28.28 40.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.936 0.398 . . . . 0.0 110.645 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.454 ' HB2' ' CD ' ' A' ' 63' ' ' PRO . 1.3 ptmm? -160.38 169.65 9.82 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.331 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.454 ' CD ' ' HB2' ' A' ' 62' ' ' LYS . 16.7 Cg_exo -67.93 5.8 0.99 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.697 2.264 . . . . 0.0 113.662 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -139.86 26.14 2.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.55 0.214 . . . . 0.0 111.326 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.815 ' O ' HD23 ' A' ' 66' ' ' LEU . 47.2 t -155.6 149.32 11.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.931 0.396 . . . . 0.0 111.506 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.815 HD23 ' O ' ' A' ' 65' ' ' VAL . 4.2 mt -146.82 117.33 7.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.663 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.675 HD22 ' N ' ' A' ' 68' ' ' VAL . 1.5 tm? -107.22 131.79 53.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.906 0.384 . . . . 0.0 111.189 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.675 ' N ' HD22 ' A' ' 67' ' ' LEU . 71.3 t -105.62 118.6 53.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.811 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.488 ' CD2' HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -133.64 -179.24 5.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.473 -179.296 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.686 HD13 ' HD1' ' A' ' 56' ' ' PHE . 7.2 tp -125.72 169.36 12.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.826 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.6 t -121.02 100.48 9.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.255 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.542 ' HD2' HG23 ' A' ' 77' ' ' ILE . 0.0 OUTLIER -75.85 163.63 27.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.549 179.926 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -43.18 -36.91 1.89 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.416 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -154.13 25.68 0.48 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.836 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 75.1 mt-10 -149.41 173.39 13.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.876 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.488 HD21 ' CD2' ' A' ' 69' ' ' TYR . 0.4 OUTLIER -128.53 144.61 51.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.5 179.593 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.55 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.0 pp -132.31 132.02 60.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.431 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.484 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 73.6 mt -80.62 125.92 30.61 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.643 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.558 HD11 ' CE1' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -87.74 -63.85 1.24 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.093 -179.759 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.526 ' O ' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -159.67 169.42 23.77 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.031 0.444 . . . . 0.0 111.381 179.775 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.889 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.2 tm? -119.79 141.06 49.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.75 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.889 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -157.03 -165.71 15.41 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.597 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 49.2 m -149.89 -175.48 5.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.787 0.327 . . . . 0.0 110.903 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 62.0 t-80 -68.51 -29.44 68.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.077 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.3 m -90.01 -23.67 21.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.187 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.11 -74.35 0.38 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.934 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 16.0 mt -68.39 -41.33 80.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.936 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.926 -179.958 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 tmm? . . . . . 0 N--CA 1.488 1.429 0 CA-C-O 120.84 0.352 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.8 mt -73.94 157.63 35.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.857 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.18 148.23 36.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.828 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.648 HD11 HD11 ' A' ' 78' ' ' LEU . 9.1 tt -121.56 154.88 36.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.981 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.731 ' HB2' HG22 ' A' ' 77' ' ' ILE . 5.4 t30 -140.4 171.23 14.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.79 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.9 mp -139.68 129.3 24.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.991 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.4 169.46 8.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.847 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -29.92 67.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.002 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.2 m -77.11 -56.52 4.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.008 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.437 ' CZ ' HD13 ' A' ' 78' ' ' LEU . 62.7 t80 -58.16 -33.58 69.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.048 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -61.26 -42.85 99.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.086 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.578 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 14.0 mttm -90.13 -16.59 29.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.565 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.405 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 1.8 m-20 -90.78 -11.17 40.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.496 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.652 ' O ' HD13 ' A' ' 18' ' ' LEU . 25.4 t80 -90.84 -67.56 0.84 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.206 -179.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.789 ' HA ' HD22 ' A' ' 18' ' ' LEU . 28.4 t0 -90.84 -33.13 15.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.312 -0.404 . . . . 0.0 112.082 -179.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.578 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 2.9 mttt -74.53 -28.04 60.8 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.948 -179.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.405 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 30.6 tp -70.92 -35.77 72.39 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.789 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.1 OUTLIER -57.99 -33.17 68.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.66 179.812 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 mt -90.05 -6.86 55.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.435 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -96.07 27.15 3.77 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.713 0.292 . . . . 0.0 111.215 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.71 23.03 19.5 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.73 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.46 ' CD1' HD12 ' A' ' 18' ' ' LEU . 11.8 t80 -116.61 122.99 46.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.871 0.367 . . . . 0.0 110.774 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.424 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 14.6 t0 -66.65 128.84 37.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.898 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.862 ' HA ' HD23 ' A' ' 27' ' ' LEU . 7.8 p-10 -78.1 -3.2 41.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.517 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.2 t -82.15 -27.32 32.8 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.685 0.279 . . . . 0.0 111.106 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.3 t -80.57 -36.65 16.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.439 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.862 HD23 ' HA ' ' A' ' 24' ' ' ASP . 2.0 pp -57.1 -37.37 71.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.056 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -57.76 -24.09 55.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.204 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -78.61 -35.37 45.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.112 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.742 HG21 HG11 ' A' ' 65' ' ' VAL . 11.5 p -90.1 -43.49 14.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.226 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.583 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -58.39 -33.04 46.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.772 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.738 HD23 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -60.06 -56.64 19.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.641 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.738 ' N ' HD23 ' A' ' 32' ' ' LEU . 85.0 m -55.59 -24.05 30.69 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.378 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.547 HD12 ' HA ' ' A' ' 31' ' ' ILE . 16.1 mt -86.61 -34.4 19.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.759 0.314 . . . . 0.0 111.214 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -103.75 20.15 18.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.436 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.444 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 0.7 OUTLIER -116.14 21.12 13.93 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 -179.708 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.405 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 4.4 ptmm? 44.01 31.23 0.49 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.481 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -93.86 135.44 24.88 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.897 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -74.84 138.07 22.96 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.499 2.133 . . . . 0.0 112.284 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 33.4 mt -90.2 125.44 35.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.797 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -69.22 155.25 93.93 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.839 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -68.68 -10.24 28.5 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.557 2.171 . . . . 0.0 112.532 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.3 pp0? -86.3 7.5 25.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.438 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -92.98 13.91 19.26 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.599 0.238 . . . . 0.0 111.229 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 58.04 41.23 24.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.88 0.371 . . . . 0.0 111.041 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -86.93 111.79 21.16 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.98 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 11.7 m80 -164.72 -178.35 5.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.907 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -87.18 156.47 19.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.083 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.482 HD11 ' CD ' ' A' ' 58' ' ' GLU . 78.0 mt -109.02 176.92 4.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.934 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -124.8 152.65 43.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.876 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 60.91 111.11 0.01 OUTLIER Glycine 0 CA--C 1.508 -0.37 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.531 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 70.38 -44.27 0.57 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.748 0.309 . . . . 0.0 110.878 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 3.4 m0 -104.55 36.24 2.48 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.9 0.381 . . . . 0.0 110.915 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.445 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.1 OUTLIER -74.54 -49.95 4.76 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.159 -179.949 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.445 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 96.0 Cg_endo -84.7 28.99 0.55 Allowed 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.704 2.27 . . . . 0.0 113.018 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.402 ' CD1' ' O ' ' A' ' 55' ' ' PRO . 24.2 m-85 -139.8 170.42 15.92 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.742 0.306 . . . . 0.0 110.832 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.441 ' O ' HG13 ' A' ' 68' ' ' VAL . 24.6 ttm180 -128.73 139.24 52.31 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.996 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.482 ' CD ' HD11 ' A' ' 49' ' ' LEU . 0.8 OUTLIER -97.61 173.19 7.26 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.804 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -169.55 109.95 0.44 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.834 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.416 ' CD2' HD22 ' A' ' 66' ' ' LEU . 9.0 m170 -87.15 78.42 8.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.853 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.671 HD11 ' HB3' ' A' ' 67' ' ' LEU . 3.4 mp -58.26 -50.97 76.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.034 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.504 ' HD3' HG22 ' A' ' 61' ' ' ILE . 2.3 mmmt -115.98 171.73 4.4 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.729 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.428 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 14.3 Cg_exo -68.81 -2.19 9.02 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.681 2.254 . . . . 0.0 112.947 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -145.85 29.49 1.1 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.823 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.804 ' O ' HD23 ' A' ' 66' ' ' LEU . 47.9 t -139.47 147.39 24.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.217 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.804 HD23 ' O ' ' A' ' 65' ' ' VAL . 2.0 mt -147.35 92.15 2.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.777 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.671 ' HB3' HD11 ' A' ' 61' ' ' ILE . 3.3 tm? -85.15 131.78 34.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.979 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.643 ' N ' HD13 ' A' ' 67' ' ' LEU . 96.9 t -109.84 116.05 51.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.042 179.046 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.599 ' CE2' HD11 ' A' ' 76' ' ' LEU . 21.7 p90 -134.33 156.35 48.62 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.233 -179.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.782 ' HB2' HD11 ' A' ' 77' ' ' ILE . 4.3 tp -111.74 -179.79 3.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.891 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.0 t -130.34 108.12 15.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.095 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.68 173.89 6.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.869 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -59.59 102.78 0.16 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.888 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 55.78 25.53 8.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.101 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 84.8 mt-10 -153.43 130.34 10.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.855 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.599 HD11 ' CE2' ' A' ' 69' ' ' TYR . 0.5 OUTLIER -97.31 142.64 28.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.77 179.862 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.782 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.2 pp -129.26 136.29 59.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.305 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.648 HD11 HD11 ' A' ' 4' ' ' LEU . 70.6 mt -87.73 132.23 34.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.645 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.74 -61.29 1.75 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.093 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.409 ' NH2' HG21 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -172.99 162.89 4.72 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.921 0.391 . . . . 0.0 111.358 -179.982 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.569 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.5 tm? -115.36 131.25 56.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.845 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.569 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -139.15 -162.08 8.98 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.498 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 95.7 p -147.8 169.62 19.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.865 0.364 . . . . 0.0 110.819 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -59.42 -28.95 67.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.962 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 18.4 m -90.11 -20.97 22.51 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.183 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -88.52 -75.0 0.44 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.09 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.703 HD12 ' HB2' ' A' ' 66' ' ' LEU . 46.2 mt -56.97 -41.99 79.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.227 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.255 -0.879 . . . . 0.0 111.025 179.998 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.9 ttp . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.708 0.289 . . . . 0.0 111.504 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 11.6 mt -135.02 162.89 31.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.838 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.82 138.29 58.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.829 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.416 HD23 ' N ' ' A' ' 5' ' ' ASN . 8.5 tt -116.0 154.68 29.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.927 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.709 ' HB2' HG22 ' A' ' 77' ' ' ILE . 6.6 t30 -135.8 172.41 13.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.827 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.4 mp -139.7 123.13 17.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.918 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -98.55 160.25 14.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.8 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.8 tttp -59.72 -34.87 73.47 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.884 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.38 -25.08 63.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.026 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.404 ' HA ' ' OD2' ' A' ' 13' ' ' ASP . 36.1 t80 -85.34 -33.9 21.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.979 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -58.73 -31.63 68.48 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.086 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.458 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 11.0 mtpp -90.34 -5.23 56.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.857 -179.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.457 ' HB2' ' HB3' ' A' ' 81' ' ' LEU . 17.1 p30 -90.69 -17.46 26.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.808 0.337 . . . . 0.0 111.466 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.802 ' CE2' HD13 ' A' ' 27' ' ' LEU . 30.2 t80 -91.18 -66.77 0.9 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.309 -179.537 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -91.3 -43.02 10.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.032 -179.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.458 ' HB3' ' O ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -71.24 -16.73 62.51 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.675 0.25 . . . . 0.0 111.675 -178.949 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.442 ' HB2' ' C ' ' A' ' 13' ' ' ASP . 1.5 tt -80.29 -36.89 33.75 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.014 0.435 . . . . 0.0 110.014 179.3 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.717 HD13 ' HB3' ' A' ' 24' ' ' ASP . 0.4 OUTLIER -66.8 -42.65 85.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.785 179.707 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.9 mt -60.55 -41.0 93.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.888 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.82 -27.53 63.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.911 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.96 39.89 0.21 Allowed Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.537 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.426 ' CG ' HD22 ' A' ' 17' ' ' LEU . 76.4 t80 -119.75 154.09 34.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.815 0.34 . . . . 0.0 110.823 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.43 ' O ' HG12 ' A' ' 26' ' ' VAL . 5.6 t0 -68.29 132.27 46.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.922 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.717 ' HB3' HD13 ' A' ' 18' ' ' LEU . 5.5 p-10 -90.64 -26.28 19.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.024 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.8 m -68.52 -32.13 71.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.319 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.43 HG12 ' O ' ' A' ' 23' ' ' ASP . 14.1 p -67.85 -30.92 50.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.412 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.802 HD13 ' CE2' ' A' ' 14' ' ' PHE . 1.0 OUTLIER -63.88 -36.66 84.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.021 -179.839 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -64.38 -18.82 65.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.221 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -86.95 -36.71 18.16 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.094 -179.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.766 HG13 HD12 ' A' ' 31' ' ' ILE . 13.3 p -86.05 -47.8 16.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.369 -179.768 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.766 HD12 HG13 ' A' ' 30' ' ' VAL . 1.7 mp -59.58 -40.12 81.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.958 0.408 . . . . 0.0 110.105 179.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.833 HD23 ' N ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -52.21 -62.9 1.34 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.804 179.78 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.833 ' N ' HD23 ' A' ' 32' ' ' LEU . 99.3 m -51.59 -41.0 60.87 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.788 0.328 . . . . 0.0 111.139 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 78.9 mt -59.2 -36.22 74.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.71 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.414 ' HB3' ' NH1' ' A' ' 35' ' ' ARG . 3.0 mtm105 -104.18 19.99 19.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.239 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.452 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 1.4 mmpt? -108.58 15.5 23.72 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.547 0.213 . . . . 0.0 111.496 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.6 mtmt 59.43 21.52 9.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.68 0.276 . . . . 0.0 110.604 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -89.36 110.76 41.14 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.15 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.62 115.03 4.18 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.445 2.097 . . . . 0.0 112.276 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.501 HD13 ' SG ' ' A' ' 59' ' ' CYS . 3.4 mt -61.39 140.62 58.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.89 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -74.09 154.59 88.56 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.894 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.21 -12.49 35.78 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.618 2.212 . . . . 0.0 112.499 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -87.22 8.89 22.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.409 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -90.49 10.07 26.77 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.695 -0.229 . . . . 0.0 111.218 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 64.19 41.7 5.98 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.912 0.387 . . . . 0.0 110.971 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -87.88 79.71 8.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.903 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -139.66 -179.81 6.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.838 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -81.17 123.58 28.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.185 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.438 HD11 ' CG ' ' A' ' 58' ' ' GLU . 10.2 mt -72.21 -177.52 2.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.846 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.2 mttt -125.25 171.14 10.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.802 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.03 -131.27 11.64 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.467 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 19.8 mttt -63.74 -31.45 72.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.719 0.295 . . . . 0.0 110.868 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -97.5 38.97 1.22 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.96 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.439 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 19.4 mttt -73.28 -50.31 6.45 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.09 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.439 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 4.7 Cg_exo -79.81 44.84 1.8 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.883 2.389 . . . . 0.0 112.464 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.404 ' CG ' ' O ' ' A' ' 55' ' ' PRO . 82.6 m-85 -156.7 178.29 10.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.831 0.348 . . . . 0.0 110.953 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.521 ' O ' HG13 ' A' ' 68' ' ' VAL . 0.1 OUTLIER -132.85 131.37 40.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.841 179.968 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.438 ' CG ' HD11 ' A' ' 49' ' ' LEU . 1.8 tt0 -95.99 171.33 8.69 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.938 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.501 ' SG ' HD13 ' A' ' 40' ' ' LEU . 11.5 t -171.02 118.8 0.49 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.817 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.437 ' CD2' ' N ' ' A' ' 60' ' ' HIS . 4.2 m-70 -93.3 99.98 12.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.937 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.589 ' H ' HD12 ' A' ' 61' ' ' ILE . 4.8 mp -70.42 -53.65 21.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.904 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.445 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 0.1 OUTLIER -112.64 172.25 3.68 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.49 179.757 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.445 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 18.1 Cg_exo -65.99 -4.6 10.48 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.51 2.14 . . . . 0.0 112.931 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -143.59 28.46 1.46 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.029 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.736 HG11 HG21 ' A' ' 30' ' ' VAL . 58.4 t -140.46 143.46 29.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.334 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.758 HD12 HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -159.12 111.05 2.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.792 179.742 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.59 HD12 ' O ' ' A' ' 68' ' ' VAL . 0.1 OUTLIER -113.48 134.45 54.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.865 -179.885 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.59 ' O ' HD12 ' A' ' 67' ' ' LEU . 21.7 t -91.88 145.91 6.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.92 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 51.7 p90 -156.17 160.13 39.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.987 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.694 ' HB2' HD11 ' A' ' 77' ' ' ILE . 2.6 tp -109.32 161.24 15.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.824 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.9 t -120.92 100.62 9.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.084 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.56 166.32 23.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.817 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -40.45 -32.25 0.19 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.596 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -167.35 37.7 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.829 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -160.51 102.84 1.38 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.106 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.439 ' C ' HD23 ' A' ' 76' ' ' LEU . 10.5 tt -67.92 134.96 51.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.66 179.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.709 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.2 pp -126.37 128.65 71.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.333 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 82.5 mt -74.27 149.2 40.86 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.546 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -109.81 -71.03 0.78 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.261 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.59 159.21 36.84 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.163 0.506 . . . . 0.0 111.106 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.802 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.9 tm? -113.79 136.78 52.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.535 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.802 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -157.46 173.33 34.91 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.654 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.5 m -108.73 170.27 8.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.839 0.352 . . . . 0.0 110.868 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -59.09 -26.72 64.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.059 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.7 t -83.79 -27.51 28.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.136 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -81.29 -69.74 0.59 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.022 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.758 HD12 HD12 ' A' ' 66' ' ' LEU . 35.1 mt -67.6 -37.87 83.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.002 -179.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.207 -0.901 . . . . 0.0 110.892 -179.982 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.3 mtp . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.78 0.324 . . . . 0.0 111.234 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.685 HD12 ' HB2' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -109.79 154.42 23.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.922 179.959 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.52 146.62 39.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.979 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.418 HD11 HD11 ' A' ' 78' ' ' LEU . 7.3 tt -122.01 152.33 39.87 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.861 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.743 ' HB2' HG22 ' A' ' 77' ' ' ILE . 1.8 t30 -138.88 171.36 14.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.937 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.0 mp -147.12 116.69 7.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.919 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -79.82 171.14 15.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.851 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.3 ttpt -60.71 -31.24 70.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.942 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.1 m -72.99 -50.22 24.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.884 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -59.96 -35.7 75.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.812 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -63.41 -37.28 86.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.955 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.561 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 4.7 mmtt -89.16 -22.86 22.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.084 0.468 . . . . 0.0 111.097 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.442 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 4.9 m-20 -90.95 -11.11 40.01 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.232 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.637 ' O ' HD13 ' A' ' 18' ' ' LEU . 29.3 t80 -90.86 -67.38 0.85 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.833 0.349 . . . . 0.0 111.367 -179.558 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.821 ' HA ' HD22 ' A' ' 18' ' ' LEU . 49.6 m-20 -91.09 -33.26 15.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.193 -179.18 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.561 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 12.6 mmtt -76.69 -26.79 55.13 Favored 'General case' 0 C--N 1.334 -0.096 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.161 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.442 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 29.2 tp -71.8 -33.01 68.19 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.185 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.821 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.1 OUTLIER -57.16 -33.58 67.56 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.821 179.967 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.7 mt -89.91 -3.32 58.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.454 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -97.7 26.81 4.77 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.669 0.271 . . . . 0.0 110.995 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 93.26 23.07 25.5 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.786 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.498 ' CD1' HD12 ' A' ' 18' ' ' LEU . 13.0 t80 -110.26 144.19 39.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.834 0.349 . . . . 0.0 110.797 179.768 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.419 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 5.1 t0 -99.61 113.4 25.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.004 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -58.1 -21.03 44.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.424 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.4 m -50.28 -54.43 21.34 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.775 0.322 . . . . 0.0 111.206 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.4 t -68.6 -34.62 66.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.984 0.421 . . . . 0.0 111.156 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.566 HD22 HD11 ' A' ' 18' ' ' LEU . 6.8 tp -65.56 -33.57 76.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.702 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -56.54 -57.92 10.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.128 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.558 ' HA ' HD22 ' A' ' 32' ' ' LEU . 4.6 mt-10 -50.5 -25.78 4.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.466 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.658 HG13 HG21 ' A' ' 61' ' ' ILE . 58.0 t -80.98 -68.25 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.911 0.386 . . . . 0.0 111.573 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.532 HD13 ' CD1' ' A' ' 27' ' ' LEU . 1.1 mp -51.38 -46.33 34.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.842 -179.286 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.832 HD23 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -55.96 -24.6 39.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.645 0.26 . . . . 0.0 111.314 -179.579 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.832 ' N ' HD23 ' A' ' 32' ' ' LEU . 27.4 m -82.11 -30.43 31.17 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.053 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.78 HD21 HD21 ' A' ' 40' ' ' LEU . 3.0 mt -90.13 -28.57 18.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.459 -179.634 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.401 ' HB3' ' NH1' ' A' ' 35' ' ' ARG . 14.0 mtm105 -94.16 20.11 8.43 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.692 -179.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.466 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 4.2 mttt -118.19 -55.72 2.22 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.142 -0.223 . . . . 0.0 110.946 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.466 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 7.3 pttt 156.12 -20.53 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.965 179.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -59.44 111.47 3.84 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.955 -179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 158.73 56.03 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.368 2.046 . . . . 0.0 112.164 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.78 HD21 HD21 ' A' ' 34' ' ' LEU . 13.0 mt -82.64 116.03 21.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.905 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.405 ' HB2' ' CE2' ' A' ' 44' ' ' PHE . 83.3 m-20 -62.66 158.4 51.26 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.956 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.47 -11.33 30.97 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.626 2.217 . . . . 0.0 112.505 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -93.08 17.21 11.23 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.203 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.405 ' CE2' ' HB2' ' A' ' 41' ' ' ASP . 19.6 m-85 -98.04 6.67 47.36 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.261 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 44.5 mm-40 64.8 41.61 4.95 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.848 0.356 . . . . 0.0 110.889 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -86.62 90.4 8.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.933 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 70.2 m-70 -136.67 173.16 12.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.982 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.07 158.01 32.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.156 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.74 HD21 ' CD ' ' A' ' 58' ' ' GLU . 1.8 mp -112.07 -175.43 2.69 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.832 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.3 mttm -124.04 167.68 13.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.909 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 77.29 -133.27 13.02 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.497 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 10.8 mptt -60.45 -31.66 70.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.78 0.324 . . . . 0.0 110.854 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 17.1 m95 -98.63 38.69 1.33 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.973 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.5 -53.73 16.24 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.953 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.415 ' HG2' ' CE1' ' A' ' 56' ' ' PHE . 93.8 Cg_endo -84.94 34.62 0.51 Allowed 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.644 2.229 . . . . 0.0 112.609 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.463 ' HE2' HD21 ' A' ' 79' ' ' LEU . 81.3 m-85 -132.25 -175.45 3.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.878 0.371 . . . . 0.0 110.879 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.11 137.59 36.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.857 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.74 ' CD ' HD21 ' A' ' 49' ' ' LEU . 2.1 tt0 -98.66 171.33 8.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.819 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.476 ' SG ' HD13 ' A' ' 40' ' ' LEU . 9.7 t -167.08 111.88 0.74 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.875 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.63 ' CE1' HD22 ' A' ' 66' ' ' LEU . 10.6 m170 -90.5 82.78 5.84 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.898 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.658 HG21 HG13 ' A' ' 30' ' ' VAL . 3.5 mp -56.13 -31.72 32.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.85 0.357 . . . . 0.0 110.93 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.529 ' HB2' HG23 ' A' ' 65' ' ' VAL . 0.0 OUTLIER -130.59 170.38 11.28 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.653 179.932 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.42 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 11.5 Cg_exo -70.75 0.96 5.59 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.852 2.368 . . . . 0.0 112.952 -179.667 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -147.27 27.46 1.03 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.788 0.328 . . . . 0.0 110.831 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.832 ' O ' HD23 ' A' ' 66' ' ' LEU . 40.6 t -135.26 152.58 32.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.08 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.832 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.8 OUTLIER -146.98 104.2 3.67 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.693 179.771 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.632 ' HB3' HD11 ' A' ' 61' ' ' ILE . 4.2 tp -104.95 121.75 44.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.034 -179.66 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.626 ' N ' HD12 ' A' ' 67' ' ' LEU . 46.3 t -99.08 135.93 32.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.794 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.458 ' CD1' HD11 ' A' ' 76' ' ' LEU . 46.4 p90 -153.3 161.97 41.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.051 -179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.743 ' O ' HD12 ' A' ' 76' ' ' LEU . 5.4 tp -109.96 169.06 8.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.777 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.1 t -127.34 106.66 15.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.133 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.43 163.34 21.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.675 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -43.62 -40.82 4.29 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.467 -179.759 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -150.04 29.25 0.73 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.897 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -151.26 151.67 32.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.828 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.743 HD12 ' O ' ' A' ' 70' ' ' LEU . 37.5 tp -115.09 137.14 52.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.691 179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.743 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.0 pp -130.76 131.3 64.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.275 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.418 HD11 HD11 ' A' ' 4' ' ' LEU . 41.2 mt -82.66 136.9 34.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.788 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.463 HD21 ' HE2' ' A' ' 56' ' ' PHE . 0.3 OUTLIER -92.29 -71.29 0.65 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.982 -179.782 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.417 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -157.42 165.6 35.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.138 -179.957 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.578 ' C ' HD13 ' A' ' 81' ' ' LEU . 3.4 tm? -122.4 123.51 41.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.806 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -138.24 -169.59 11.63 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.416 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -140.29 -178.25 5.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.79 0.328 . . . . 0.0 110.865 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 5.6 t-80 -67.99 -28.71 67.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.032 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 17.9 m -89.95 -26.9 20.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.067 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.81 -68.6 0.68 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.048 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.658 HD12 ' HB2' ' A' ' 66' ' ' LEU . 16.6 mt -71.75 -38.6 70.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.068 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.903 -179.982 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.4 mmm . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.8 0.333 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.1 mt 61.08 165.99 0.09 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.88 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.4 ' HB2' ' HG3' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -59.02 150.44 24.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.859 179.946 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.628 HD11 HD11 ' A' ' 78' ' ' LEU . 8.6 tt -116.09 144.84 43.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.086 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.84 ' HB2' HG22 ' A' ' 77' ' ' ILE . 2.0 t-20 -133.67 -173.03 3.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.804 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.9 mp -143.91 140.77 29.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.96 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.8 165.58 11.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.819 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.84 -31.33 70.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.795 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.0 t -74.62 -47.8 30.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.941 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.43 ' CE2' HD13 ' A' ' 78' ' ' LEU . 30.5 t80 -59.53 -38.04 79.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.934 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -60.71 -35.11 75.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.931 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.569 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 7.3 mtmp? -85.94 -20.0 29.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.147 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -90.59 -11.51 39.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.282 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.683 ' O ' HD13 ' A' ' 18' ' ' LEU . 46.0 t80 -90.57 -66.97 0.88 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.225 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.82 ' HA ' HD22 ' A' ' 18' ' ' LEU . 7.8 m-20 -90.96 -32.17 16.06 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.084 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.569 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -77.34 -27.29 52.67 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.263 -179.106 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.453 ' O ' ' HB3' ' A' ' 22' ' ' PHE . 1.1 tt -73.42 -33.62 65.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.936 0.398 . . . . 0.0 109.974 179.447 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.82 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.2 OUTLIER -54.91 -42.58 72.36 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.111 -179.983 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 85.8 mt -82.88 -3.26 56.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.543 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.96 37.44 1.31 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.853 0.359 . . . . 0.0 110.983 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 82.86 25.65 48.67 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.387 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.471 ' CD1' HD12 ' A' ' 18' ' ' LEU . 8.9 t80 -116.35 132.18 56.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.755 0.312 . . . . 0.0 110.782 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.403 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 13.5 t0 -87.34 124.11 33.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.907 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.841 ' HA ' HD23 ' A' ' 27' ' ' LEU . 11.5 p-10 -55.96 -27.43 52.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.069 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 72.7 m -57.09 -22.77 42.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.174 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.433 ' HB ' ' CZ ' ' A' ' 22' ' ' PHE . 27.1 t -83.64 -45.65 18.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.312 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.841 HD23 ' HA ' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -59.09 -35.64 73.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.905 -179.798 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -57.29 -26.75 61.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.859 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -73.89 -45.36 51.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.881 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.582 HG23 ' CG1' ' A' ' 61' ' ' ILE . 9.2 p -78.74 -47.99 22.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.274 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.498 ' N ' HG13 ' A' ' 30' ' ' VAL . 1.4 mp -50.08 -35.95 11.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.928 0.394 . . . . 0.0 110.413 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.806 HD23 ' N ' ' A' ' 33' ' ' THR . 1.0 OUTLIER -52.76 -62.6 1.54 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.419 179.448 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.806 ' N ' HD23 ' A' ' 32' ' ' LEU . 72.3 m -51.41 -25.74 6.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.552 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 18.8 mt -73.58 -66.54 0.68 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.789 0.328 . . . . 0.0 110.933 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.6 mtt180 -60.21 -52.0 67.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.78 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.704 ' HE2' HD21 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -68.16 -14.31 62.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.405 179.849 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.528 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 3.0 ptmt 51.96 69.17 0.7 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.583 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.738 ' HB3' HG23 ' A' ' 33' ' ' THR . 7.2 tt0 -79.18 136.17 57.42 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.601 179.413 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.93 104.81 0.2 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.423 2.082 . . . . 0.0 112.104 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 64.0 mt -67.47 127.76 33.89 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.009 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -80.89 157.93 71.01 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.841 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -64.49 -26.97 62.24 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 122.505 2.137 . . . . 0.0 112.239 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -62.24 -23.71 66.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.033 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -62.52 -18.48 62.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.172 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 63.82 41.76 6.59 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.822 0.344 . . . . 0.0 110.983 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -77.39 87.32 3.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.766 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -134.65 -177.67 4.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.934 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -90.43 124.2 34.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.209 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.714 HD11 ' CD ' ' A' ' 58' ' ' GLU . 15.6 mt -68.47 -177.38 0.92 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.796 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.0 mmtp -125.12 156.98 37.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.917 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 78.88 -116.85 4.43 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.552 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.9 tppt? -61.18 -30.23 70.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.742 0.306 . . . . 0.0 111.098 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.433 ' CE3' HD13 ' A' ' 49' ' ' LEU . 5.5 m-90 -114.41 47.88 1.18 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.937 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 1.4 tttt -79.59 -50.99 1.23 Allowed Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.256 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 83.4 Cg_endo -82.35 11.21 3.25 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.534 2.156 . . . . 0.0 112.853 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.497 ' CD1' HD21 ' A' ' 79' ' ' LEU . 95.6 m-85 -118.49 174.65 6.13 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.759 0.314 . . . . 0.0 110.972 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -125.42 127.15 46.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.952 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.714 ' CD ' HD11 ' A' ' 49' ' ' LEU . 2.7 tt0 -95.98 156.38 16.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.742 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 16.5 t -160.02 131.97 6.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.785 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.4 m170 -111.04 90.83 3.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.964 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.582 ' CG1' HG23 ' A' ' 30' ' ' VAL . 4.0 mp -55.4 -24.64 16.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.716 179.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.444 ' HB2' ' CD ' ' A' ' 63' ' ' PRO . 1.6 ptmt -155.15 169.82 9.67 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.392 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.444 ' CD ' ' HB2' ' A' ' 62' ' ' LYS . 16.3 Cg_exo -68.26 3.79 1.92 Allowed 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.688 2.259 . . . . 0.0 113.325 -179.463 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -138.31 30.38 2.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.703 0.287 . . . . 0.0 111.225 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.794 ' O ' HD23 ' A' ' 66' ' ' LEU . 79.3 t -155.38 153.56 7.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.91 0.386 . . . . 0.0 111.244 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.794 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.2 OUTLIER -150.34 86.91 1.42 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.481 179.657 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.461 ' HB3' ' CD1' ' A' ' 61' ' ' ILE . 4.3 tp -85.47 109.05 18.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.948 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.54 ' CG1' HD22 ' A' ' 79' ' ' LEU . 57.4 t -84.61 135.26 25.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.669 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -143.25 155.03 44.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.97 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.719 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.5 OUTLIER -106.29 147.3 29.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.891 -179.879 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.747 ' HA ' HD12 ' A' ' 76' ' ' LEU . 26.4 t -101.54 116.69 45.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.155 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.62 162.76 14.04 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.791 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -44.19 -48.89 9.3 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.594 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -139.24 29.66 2.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.971 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.4 ' HG3' ' HB2' ' A' ' 3' ' ' LYS . 15.6 mp0 -160.35 171.41 19.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.72 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.747 HD12 ' HA ' ' A' ' 71' ' ' VAL . 7.6 tp -130.9 148.59 52.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.785 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.84 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.1 pp -135.27 137.89 49.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.33 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.628 HD11 HD11 ' A' ' 4' ' ' LEU . 76.0 mt -81.68 133.58 35.37 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.651 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.54 HD22 ' CG1' ' A' ' 68' ' ' VAL . 0.3 OUTLIER -88.93 -70.42 0.65 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.972 -179.753 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.471 ' HD2' HD21 ' A' ' 87' ' ' LEU . 0.1 OUTLIER -158.1 179.44 9.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.223 -179.901 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.587 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.1 tm? -132.93 128.22 36.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.742 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.587 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -166.83 168.63 40.35 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.591 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.46 ' C ' HD11 ' A' ' 66' ' ' LEU . 87.9 p -109.82 177.5 4.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.869 0.366 . . . . 0.0 110.71 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.496 ' N ' HD11 ' A' ' 66' ' ' LEU . 14.7 t-80 -60.72 -26.69 67.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.007 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.44 -28.76 52.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.042 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -89.77 -71.82 0.59 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.022 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.471 HD21 ' HD2' ' A' ' 80' ' ' ARG . 29.0 mt -58.44 -42.94 88.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.04 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.833 179.971 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.836 0.351 . . . . 0.0 111.166 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.4 mt 60.83 -179.2 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.963 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -104.28 151.51 23.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.894 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.608 HD21 HD11 ' A' ' 78' ' ' LEU . 5.7 tp -117.89 143.36 46.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.869 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.748 ' HB2' HG22 ' A' ' 77' ' ' ILE . 2.3 t30 -130.06 171.69 12.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.878 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.2 mp -135.51 115.35 13.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.838 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.2 mmtm -82.9 169.59 15.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.772 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.0 tttt -59.94 -31.06 69.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.891 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.1 m -73.37 -46.4 49.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.888 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -61.02 -29.95 70.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.896 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -59.22 -53.72 55.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.939 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.483 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 0.6 OUTLIER -78.33 -16.69 57.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.02 0.438 . . . . 0.0 111.31 -179.961 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.44 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 8.4 m-20 -90.52 -17.71 26.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.886 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.56 ' O ' HD13 ' A' ' 18' ' ' LEU . 76.9 t80 -90.94 -68.34 0.8 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.335 -179.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.803 ' HA ' HD22 ' A' ' 18' ' ' LEU . 15.3 m-20 -90.82 -41.57 11.14 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -178.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.483 ' HB3' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -69.96 -23.92 63.25 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.205 -179.014 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.44 ' HB2' ' HA ' ' A' ' 13' ' ' ASP . 25.7 tp -73.07 -35.6 66.69 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.803 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.1 OUTLIER -58.08 -43.44 87.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.854 179.855 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 20.2 mt -79.81 -4.69 53.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.393 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.69 22.85 7.59 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.759 0.314 . . . . 0.0 111.153 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 96.78 23.04 16.48 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.823 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.499 ' CD1' HD12 ' A' ' 18' ' ' LEU . 11.1 t80 -114.19 137.45 51.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.813 0.34 . . . . 0.0 110.839 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.424 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 1.9 t0 -92.68 119.65 32.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.033 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -59.17 -19.01 41.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.473 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.4 p -46.82 -49.08 20.59 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 120.698 0.285 . . . . 0.0 111.309 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.459 HG13 ' HD2' ' A' ' 62' ' ' LYS . 21.7 t -74.53 -34.61 35.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.985 0.422 . . . . 0.0 111.111 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.68 ' CD1' HD13 ' A' ' 31' ' ' ILE . 5.6 tp -64.72 -39.01 92.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.722 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -54.85 -41.94 71.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.18 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.546 ' C ' HD22 ' A' ' 32' ' ' LEU . 3.5 mt-10 -69.8 -12.22 61.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.393 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.424 HG13 HD13 ' A' ' 61' ' ' ILE . 77.7 t -90.43 -70.94 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.847 0.356 . . . . 0.0 111.693 -179.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.68 HD13 ' CD1' ' A' ' 27' ' ' LEU . 1.4 mp -49.46 -40.0 14.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.036 -179.067 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.764 HD23 ' N ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -62.4 -14.63 42.47 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.369 -179.669 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.764 ' N ' HD23 ' A' ' 32' ' ' LEU . 92.9 m -90.08 -30.11 17.91 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.744 0.307 . . . . 0.0 110.866 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.9 mt -88.64 -31.63 18.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.398 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 31.8 mtm180 -93.21 20.21 7.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.338 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.464 ' O ' ' CG ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -123.47 24.46 8.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.831 0.348 . . . . 0.0 111.341 -179.821 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.464 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 3.9 pttp 46.71 47.21 15.01 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.319 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -123.82 109.89 29.9 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.786 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -66.35 135.75 40.88 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.396 2.064 . . . . 0.0 112.238 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.43 HD13 ' SG ' ' A' ' 59' ' ' CYS . 1.7 mt -64.03 -178.99 0.37 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.847 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.07 160.49 38.87 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.909 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.53 -18.34 48.85 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.601 2.201 . . . . 0.0 112.438 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.59 -1.64 38.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.523 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.445 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.3 m-85 -78.41 -3.01 41.12 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.61 0.243 . . . . 0.0 111.401 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 62.39 43.62 7.96 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.883 0.373 . . . . 0.0 110.866 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -88.43 100.46 13.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.907 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 75.7 m80 -133.22 173.37 11.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.95 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -81.09 131.86 35.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.072 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.763 HD11 ' HG3' ' A' ' 58' ' ' GLU . 7.1 mt -81.21 -178.78 7.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.875 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.21 157.09 41.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.879 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.42 ' C ' ' H ' ' A' ' 53' ' ' TRP . . . 60.31 109.93 0.01 OUTLIER Glycine 0 CA--C 1.508 -0.402 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.516 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 70.22 -44.87 0.58 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.667 0.27 . . . . 0.0 110.966 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.42 ' H ' ' C ' ' A' ' 51' ' ' GLY . 8.3 m95 -105.09 35.7 2.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.881 0.372 . . . . 0.0 110.887 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.456 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.1 OUTLIER -68.21 -52.82 20.86 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.141 179.975 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.456 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 71.6 Cg_endo -77.79 4.51 6.01 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.435 2.09 . . . . 0.0 112.699 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.782 ' CD2' HD13 ' A' ' 70' ' ' LEU . 30.6 m-85 -104.0 172.62 6.7 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.832 0.348 . . . . 0.0 110.806 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 57.1 ttm-85 -133.03 137.6 46.51 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.918 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.763 ' HG3' HD11 ' A' ' 49' ' ' LEU . 0.8 OUTLIER -98.96 172.32 7.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.863 -179.959 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.43 ' SG ' HD13 ' A' ' 40' ' ' LEU . 17.7 t -166.13 129.47 2.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.76 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.47 ' CE1' HD22 ' A' ' 66' ' ' LEU . 2.5 m-70 -99.52 84.38 2.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.067 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.672 HD11 ' HB3' ' A' ' 67' ' ' LEU . 2.9 mp -58.17 -28.32 34.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.031 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.459 ' HD2' HG13 ' A' ' 26' ' ' VAL . 14.7 mttt -137.34 168.26 17.32 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.658 -179.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.404 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 42.5 Cg_endo -67.61 -3.19 9.77 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.397 2.065 . . . . 0.0 112.824 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -145.04 28.6 1.23 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.656 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.901 ' O ' HD23 ' A' ' 66' ' ' LEU . 51.8 t -137.73 145.79 28.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.282 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.901 HD23 ' O ' ' A' ' 65' ' ' VAL . 6.7 mt -140.32 119.78 13.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.547 179.392 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.697 HD12 ' N ' ' A' ' 68' ' ' VAL . 4.8 tp -116.16 127.88 55.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.227 -179.489 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.697 ' N ' HD12 ' A' ' 67' ' ' LEU . 46.0 t -103.97 138.09 29.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.479 179.489 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.45 ' CD1' HD11 ' A' ' 76' ' ' LEU . 46.0 p90 -151.78 164.77 36.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.914 0.387 . . . . 0.0 110.993 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.782 HD13 ' CD2' ' A' ' 56' ' ' PHE . 4.3 tp -114.37 179.69 3.88 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.851 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.6 t -122.07 111.47 30.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.03 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.32 168.29 9.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.962 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -62.05 106.47 0.72 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.846 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.3 t0 58.4 21.6 8.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.103 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -156.6 147.79 22.19 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.85 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.45 HD11 ' CD1' ' A' ' 69' ' ' TYR . 7.2 tt -111.97 147.88 34.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.873 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.77 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.1 pp -130.76 135.66 59.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.227 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.608 HD11 HD21 ' A' ' 4' ' ' LEU . 89.4 mt -84.0 148.67 26.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.707 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.419 ' HG ' ' CD2' ' A' ' 56' ' ' PHE . 0.7 OUTLIER -103.45 -68.38 0.84 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.968 -179.89 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.65 171.09 19.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.073 0.464 . . . . 0.0 111.303 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.688 HD13 ' N ' ' A' ' 82' ' ' GLY . 1.2 tm? -124.57 131.92 53.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.683 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.688 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -150.6 -161.91 10.27 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.712 -179.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -139.39 168.84 18.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.81 0.338 . . . . 0.0 110.824 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.414 ' HA ' HD11 ' A' ' 66' ' ' LEU . 2.3 t-160 -59.23 -27.78 66.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.12 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.4 m -89.99 -18.62 25.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.302 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -84.66 -67.62 0.78 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.789 0.328 . . . . 0.0 111.233 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.589 HD13 HD12 ' A' ' 66' ' ' LEU . 7.0 mp -52.52 -32.1 38.8 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.327 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.885 -179.999 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 mmt . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.747 0.308 . . . . 0.0 111.17 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.1 mp -75.15 138.21 41.86 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.051 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.36 163.06 3.24 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.651 179.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.781 HD13 ' HA ' ' A' ' 35' ' ' ARG . 1.3 tt -125.65 145.27 50.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.889 0.376 . . . . 0.0 110.985 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.462 ' HB2' HG22 ' A' ' 77' ' ' ILE . 5.5 t-20 -134.15 -176.64 4.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.988 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.7 mt -145.76 136.14 24.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.907 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -104.89 171.41 7.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.816 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.43 -34.07 72.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.937 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.9 m -66.04 -31.55 72.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.915 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.8 t80 -77.26 -32.75 55.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.915 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 87.8 mm-40 -69.94 -28.98 66.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.155 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.5 pttt -90.15 -53.26 4.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.241 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -53.61 -25.51 17.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.032 0.444 . . . . 0.0 111.133 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.895 ' O ' HD13 ' A' ' 18' ' ' LEU . 51.6 t80 -64.14 -71.21 0.18 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.724 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.411 ' HA ' ' HB2' ' A' ' 18' ' ' LEU . 1.0 OUTLIER -68.0 -26.21 65.79 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.427 179.121 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.3 ttmm -69.97 -31.02 68.52 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.675 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.475 ' O ' ' HB3' ' A' ' 22' ' ' PHE . 33.2 tp -90.28 -40.32 12.22 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 179.089 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.895 HD13 ' O ' ' A' ' 14' ' ' PHE . 4.7 mp -53.45 -36.27 61.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.01 179.759 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.528 ' C ' HD12 ' A' ' 19' ' ' LEU . 4.5 pp -90.08 -9.89 46.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.525 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -93.48 37.17 1.06 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.656 0.265 . . . . 0.0 111.204 -179.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.81 23.03 40.24 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.843 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.577 ' CZ ' HG13 ' A' ' 26' ' ' VAL . 34.7 t80 -116.77 112.11 20.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.838 0.352 . . . . 0.0 110.783 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.466 ' O ' HG12 ' A' ' 26' ' ' VAL . 3.7 t0 -57.52 146.46 29.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.083 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.654 ' HA ' HD23 ' A' ' 27' ' ' LEU . 20.3 p-10 -86.31 -11.31 52.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.18 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.9 t -78.62 -27.27 45.45 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.7 0.286 . . . . 0.0 110.998 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.577 HG13 ' CZ ' ' A' ' 22' ' ' PHE . 10.0 p -80.02 -27.43 12.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.326 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.654 HD23 ' HA ' ' A' ' 24' ' ' ASP . 1.5 pp -59.13 -38.57 79.97 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.107 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 15.8 t30 -59.23 -23.9 62.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.176 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -80.05 -45.32 18.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.145 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.779 ' CG2' HD13 ' A' ' 61' ' ' ILE . 12.4 p -77.69 -48.39 24.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.45 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.838 ' HA ' HD12 ' A' ' 34' ' ' LEU . 1.2 mp -57.05 -29.72 32.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.901 0.381 . . . . 0.0 110.43 179.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.807 HD23 ' N ' ' A' ' 33' ' ' THR . 0.2 OUTLIER -61.36 -65.85 0.63 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.273 179.382 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.807 ' N ' HD23 ' A' ' 32' ' ' LEU . 85.4 m -46.23 -24.26 0.44 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.937 -179.72 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.838 HD12 ' HA ' ' A' ' 31' ' ' ILE . 3.3 mt -89.29 -49.79 6.51 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.781 ' HA ' HD13 ' A' ' 4' ' ' LEU . 35.3 mtt180 -83.26 -16.82 44.85 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -178.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.535 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -94.38 18.88 10.36 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.624 0.249 . . . . 0.0 111.45 -179.619 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.434 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 1.3 ptpp? 45.49 48.37 10.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.33 179.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.595 ' HB3' HG23 ' A' ' 33' ' ' THR . 2.8 tp10 -90.63 136.97 27.41 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.783 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -68.07 137.08 39.83 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.453 2.102 . . . . 0.0 112.288 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.635 HD22 ' SG ' ' A' ' 59' ' ' CYS . 2.6 mt -96.15 148.33 22.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.911 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.37 164.07 21.19 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.92 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.41 -29.66 45.24 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.578 2.185 . . . . 0.0 112.252 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -19.67 65.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.101 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.424 ' CE2' ' HA ' ' A' ' 61' ' ' ILE . 4.8 m-85 -62.64 -17.87 61.22 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.234 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 73.8 mm-40 66.73 38.72 3.8 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.874 0.368 . . . . 0.0 110.881 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -76.75 122.11 24.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.893 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -168.0 -178.08 3.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.877 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.19 134.76 36.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.027 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.2 mt -70.11 -176.64 1.19 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.928 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.78 -178.32 3.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.967 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 65.81 -140.47 40.4 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.528 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.0 -7.65 54.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.532 0.206 . . . . 0.0 111.369 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 5.0 m95 -96.17 37.6 1.24 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.88 0.372 . . . . 0.0 110.832 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.503 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -69.88 -50.24 17.82 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.407 179.997 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 64.0 Cg_endo -74.58 51.62 2.67 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.175 1.916 . . . . 0.0 112.66 -179.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.655 ' HD1' HD13 ' A' ' 70' ' ' LEU . 63.8 m-85 -152.99 175.59 12.79 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.761 179.585 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.24 144.62 44.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.922 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.502 ' OE2' HD22 ' A' ' 87' ' ' LEU . 2.1 tt0 -113.26 171.63 7.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.749 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.635 ' SG ' HD22 ' A' ' 40' ' ' LEU . 8.2 t -168.34 110.75 0.57 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.925 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.593 ' CD2' HD22 ' A' ' 66' ' ' LEU . 10.8 m170 -84.9 83.62 7.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.94 179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.779 HD13 ' CG2' ' A' ' 30' ' ' VAL . 4.0 mp -53.63 -27.59 15.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.037 179.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.487 ' NZ ' HG22 ' A' ' 26' ' ' VAL . 0.0 OUTLIER -159.49 169.74 9.93 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.382 179.714 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.434 ' CD ' ' HB2' ' A' ' 62' ' ' LYS . 15.3 Cg_exo -68.77 5.52 1.31 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.705 2.27 . . . . 0.0 113.29 -179.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -138.9 24.69 2.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.56 0.219 . . . . 0.0 111.39 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.871 ' O ' HD23 ' A' ' 66' ' ' LEU . 42.0 t -155.35 145.68 12.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 121.036 0.446 . . . . 0.0 111.603 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.871 HD23 ' O ' ' A' ' 65' ' ' VAL . 15.7 mt -141.68 107.52 5.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.428 179.506 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.641 ' C ' HD13 ' A' ' 67' ' ' LEU . 2.5 tm? -99.84 134.05 43.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.933 0.397 . . . . 0.0 111.365 -179.608 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.524 ' H ' HD22 ' A' ' 67' ' ' LEU . 98.6 t -113.12 119.93 61.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.879 178.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.56 ' HB3' HD11 ' A' ' 67' ' ' LEU . 20.3 p90 -132.97 155.7 48.65 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.953 0.406 . . . . 0.0 111.323 -179.001 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.807 ' HB2' HD11 ' A' ' 77' ' ' ILE . 6.6 tp -109.54 171.09 7.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.852 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 20.2 t -122.93 104.98 15.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.262 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.0 164.41 24.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.776 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -41.94 -36.19 1.03 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.55 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -157.48 27.63 0.29 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.864 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -151.36 162.75 40.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.816 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.441 HD11 ' CD2' ' A' ' 69' ' ' TYR . 6.5 tp -114.03 147.6 38.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.583 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.807 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.2 pp -136.4 126.55 40.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.373 -179.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 78.5 mt -80.32 115.68 19.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.55 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.554 HD23 ' NH1' ' A' ' 80' ' ' ARG . 0.5 OUTLIER -72.5 -66.58 0.64 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.09 -179.82 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.599 ' O ' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -163.77 176.06 9.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.049 0.452 . . . . 0.0 111.331 179.802 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.767 HD11 HG13 ' A' ' 65' ' ' VAL . 1.4 tm? -131.86 117.44 18.51 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.714 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.483 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -120.71 -161.15 11.34 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.58 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.8 m -134.19 153.01 52.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.069 0.461 . . . . 0.0 110.912 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.848 ' HA ' HD11 ' A' ' 66' ' ' LEU . 0.6 OUTLIER -49.42 -28.48 5.23 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.344 -179.795 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 12.7 t -90.19 -20.67 22.77 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.239 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.5 -71.22 0.47 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.152 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.703 HD13 HD12 ' A' ' 66' ' ' LEU . 4.3 mp -49.93 -27.46 5.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.372 -179.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.215 -0.897 . . . . 0.0 110.916 179.982 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.948 0.404 . . . . 0.0 111.09 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 7.1 mt -86.89 167.74 14.05 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.008 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.85 146.94 40.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.874 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.405 HD21 HH21 ' A' ' 35' ' ' ARG . 0.6 OUTLIER -118.2 148.3 42.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.912 179.87 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.775 ' HB2' HG22 ' A' ' 77' ' ' ILE . 4.6 t30 -133.56 171.14 14.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.917 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.1 mt -137.97 104.13 5.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.9 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -78.41 165.94 23.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.816 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -60.39 -38.85 85.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.812 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.8 t -68.85 -31.45 70.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.924 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.474 ' CZ ' HD13 ' A' ' 78' ' ' LEU . 56.0 t80 -80.92 -37.34 29.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.936 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -57.22 -36.33 70.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.974 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.472 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 4.7 mtpm? -90.06 -17.87 26.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.14 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.452 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 3.9 m-20 -90.53 -17.26 27.34 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.276 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.568 ' O ' HD13 ' A' ' 18' ' ' LEU . 65.9 t80 -91.1 -68.43 0.79 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.425 -179.658 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.796 ' HA ' HD22 ' A' ' 18' ' ' LEU . 1.3 t0 -90.95 -40.9 11.43 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.472 ' HB3' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -70.36 -26.46 63.74 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.677 -0.409 . . . . 0.0 111.086 -179.117 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.452 ' HB2' ' HA ' ' A' ' 13' ' ' ASP . 20.5 tp -69.8 -33.32 72.2 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 179.012 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.796 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.1 OUTLIER -61.36 -30.77 70.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.802 179.904 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 21.6 mt -86.36 -32.8 20.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.066 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -60.89 -19.48 60.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.075 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 133.04 34.04 0.35 Allowed Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.574 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.482 ' HB3' ' HA ' ' A' ' 18' ' ' LEU . 12.1 t80 -113.2 146.51 39.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.737 0.303 . . . . 0.0 110.726 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.432 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 43.0 t0 -95.08 106.79 18.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.012 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -51.91 -24.99 7.13 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.317 -179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -50.68 -44.06 57.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.788 0.328 . . . . 0.0 111.158 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.6 t -77.28 -35.82 23.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.003 0.43 . . . . 0.0 111.059 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.662 HD11 HD13 ' A' ' 31' ' ' ILE . 3.9 tp -59.79 -40.31 87.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.641 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.439 ' O ' HD22 ' A' ' 32' ' ' LEU . 34.0 t30 -55.94 -42.45 76.19 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.053 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.53 ' C ' HD22 ' A' ' 32' ' ' LEU . 5.9 mm-40 -61.77 -16.62 51.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.4 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.479 ' CG1' HD13 ' A' ' 61' ' ' ILE . 60.8 t -90.33 -70.4 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.814 0.34 . . . . 0.0 111.807 -179.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.662 HD13 HD11 ' A' ' 27' ' ' LEU . 1.2 mp -50.66 -36.47 14.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.121 -0.49 . . . . 0.0 112.219 -178.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.721 HD23 ' N ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -67.24 -11.19 56.8 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 120.909 -0.316 . . . . 0.0 111.352 -179.869 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.721 ' N ' HD23 ' A' ' 32' ' ' LEU . 86.3 m -90.57 -35.84 14.8 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.925 0.393 . . . . 0.0 111.048 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.432 ' CD2' HD21 ' A' ' 40' ' ' LEU . 8.7 mt -90.06 -65.04 1.05 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.912 -179.137 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.442 ' HD2' HG23 ' A' ' 31' ' ' ILE . 12.2 mtt180 -49.54 -21.99 1.13 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.106 -179.129 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.544 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -90.49 21.25 4.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.638 0.256 . . . . 0.0 111.526 -179.882 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.438 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 0.2 OUTLIER 46.1 61.66 2.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.007 0.432 . . . . 0.0 111.513 -179.935 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -119.58 144.07 36.07 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.746 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.0 141.56 40.46 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.423 2.082 . . . . 0.0 112.379 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.716 HD22 ' CE2' ' A' ' 44' ' ' PHE . 54.0 mt -84.73 141.07 30.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.925 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.29 159.47 77.67 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.874 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -61.55 -27.03 81.38 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.603 2.202 . . . . 0.0 112.241 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -64.21 -26.54 68.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.971 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.716 ' CE2' HD22 ' A' ' 40' ' ' LEU . 3.1 m-30 -58.25 -53.53 57.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.76 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 60.91 83.53 0.14 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.959 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -92.53 105.35 17.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.878 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -130.69 -177.2 4.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.914 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -95.07 136.65 35.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.087 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.807 HD13 ' HB3' ' A' ' 53' ' ' TRP . 1.5 mp -70.11 -168.38 0.21 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.84 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.3 mmtt -137.8 150.34 47.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.791 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 60.39 110.52 0.01 OUTLIER Glycine 0 CA--C 1.507 -0.413 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.655 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.7 tptm 70.15 -45.67 0.59 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.713 0.292 . . . . 0.0 110.953 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.807 ' HB3' HD13 ' A' ' 49' ' ' LEU . 90.9 m95 -98.95 33.25 2.4 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.964 0.412 . . . . 0.0 110.822 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.484 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 1.3 tttm -70.1 -49.41 18.6 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.673 -179.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.484 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 72.9 Cg_endo -77.31 5.85 4.79 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.419 2.079 . . . . 0.0 113.191 -179.481 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -110.06 173.36 6.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.824 0.345 . . . . 0.0 110.959 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.755 ' O ' HG13 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -129.04 144.53 51.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.956 -179.858 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.657 ' HG3' HG22 ' A' ' 68' ' ' VAL . 4.1 tt0 -106.45 179.36 4.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.888 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.6 t -170.96 120.99 0.54 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.834 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.404 ' CD2' ' N ' ' A' ' 60' ' ' HIS . 13.7 m170 -99.2 78.66 2.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.976 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.538 HD11 ' HB3' ' A' ' 67' ' ' LEU . 2.9 mp -59.6 -29.14 41.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.113 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.475 ' HB2' HG23 ' A' ' 65' ' ' VAL . 14.1 mtpt -135.84 168.73 16.02 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.85 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.405 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 12.1 Cg_exo -70.03 -1.08 8.1 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.871 2.38 . . . . 0.0 112.931 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 -143.06 26.66 1.66 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.704 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.79 ' O ' HD23 ' A' ' 66' ' ' LEU . 42.8 t -137.26 150.93 26.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.107 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.868 HD12 HD12 ' A' ' 87' ' ' LEU . 1.1 mt -147.91 87.5 1.62 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.614 179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.74 HD12 ' N ' ' A' ' 68' ' ' VAL . 6.4 tp -82.94 134.31 35.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.115 -179.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.755 HG13 ' O ' ' A' ' 57' ' ' ARG . 38.8 t -113.38 140.29 34.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.665 179.69 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 52.1 p90 -155.49 162.86 40.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.111 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.69 ' HB2' HD11 ' A' ' 77' ' ' ILE . 2.2 tp -112.35 173.08 6.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.833 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -127.42 102.33 8.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.205 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.34 164.57 26.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.798 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -43.44 -43.91 5.54 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.58 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -145.12 26.39 1.34 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.994 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -150.46 167.36 27.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.798 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.1 tt -126.15 134.81 51.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.727 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.775 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.4 pp -125.73 132.53 70.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.446 -179.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.474 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 92.5 mt -77.8 139.28 39.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.605 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -94.0 -64.56 1.07 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.013 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.484 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.2 OUTLIER -168.75 171.47 8.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.988 0.423 . . . . 0.0 111.206 -179.949 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.508 ' C ' HD13 ' A' ' 81' ' ' LEU . 2.7 tm? -128.54 121.61 29.18 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.696 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.479 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -137.42 -165.97 10.59 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.642 -0.789 . . . . 0.0 112.575 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.4 m -152.43 -171.55 3.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.904 0.383 . . . . 0.0 110.822 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 -73.39 -28.45 62.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.044 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.47 -23.21 22.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.13 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -89.89 -68.75 0.76 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.984 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.868 HD12 HD12 ' A' ' 66' ' ' LEU . 72.8 mt -59.1 -42.84 91.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.94 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.226 -0.892 . . . . 0.0 110.911 -179.959 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 ptm . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.828 0.347 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 21.0 mt -130.72 179.61 5.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.961 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.86 150.98 26.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.866 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.5 tt -122.08 144.89 48.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.977 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.656 ' HB2' HG22 ' A' ' 77' ' ' ILE . 5.9 t30 -130.56 179.18 6.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.955 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -140.64 121.87 14.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.911 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -92.87 168.85 10.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.929 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -65.53 -41.17 93.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.836 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.72 -32.83 74.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.856 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.562 ' HE1' HD13 ' A' ' 67' ' ' LEU . 51.8 t80 -69.72 -30.87 68.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.873 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -63.88 -50.82 67.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.946 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.564 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 46.6 mttp -76.5 -14.16 60.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.993 0.425 . . . . 0.0 111.264 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.447 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 3.8 m-20 -90.42 -11.78 39.42 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.798 179.551 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.865 ' O ' HD13 ' A' ' 18' ' ' LEU . 37.1 t80 -90.77 -74.97 0.48 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.138 -179.687 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -90.39 -31.79 16.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.842 -179.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.564 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -77.03 -13.1 60.0 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.626 -0.429 . . . . 0.0 110.816 -179.948 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.474 HD12 ' HB3' ' A' ' 20' ' ' ASN . 27.2 tp -86.98 -30.99 20.84 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 178.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.865 HD13 ' O ' ' A' ' 14' ' ' PHE . 4.2 mp -45.57 -51.27 12.22 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.309 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.5 pp -72.42 -6.44 43.55 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.001 -179.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.474 ' HB3' HD12 ' A' ' 17' ' ' LEU . 21.2 t30 -93.29 37.63 1.04 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.745 0.307 . . . . 0.0 111.051 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.73 23.11 70.6 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.24 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.685 ' CD1' HD12 ' A' ' 18' ' ' LEU . 51.7 t80 -109.78 124.78 51.88 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.833 0.349 . . . . 0.0 110.832 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.504 ' HB3' HG12 ' A' ' 26' ' ' VAL . 18.0 t0 -64.67 141.36 58.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.927 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.894 ' HA ' HD23 ' A' ' 27' ' ' LEU . 2.4 p30 -94.0 -20.62 19.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.352 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.6 m -76.64 -26.43 54.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.831 0.348 . . . . 0.0 111.286 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.504 HG12 ' HB3' ' A' ' 23' ' ' ASP . 13.7 p -78.76 -33.29 16.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.373 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.894 HD23 ' HA ' ' A' ' 24' ' ' ASP . 1.3 pp -62.04 -36.95 83.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.043 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.56 ' O ' HD22 ' A' ' 32' ' ' LEU . 43.2 t-20 -58.89 -24.81 62.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.046 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.407 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 9.8 mt-10 -75.62 -33.95 60.54 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.1 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.697 HG13 HD12 ' A' ' 31' ' ' ILE . 11.4 p -90.7 -34.52 6.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.557 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.697 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -70.56 -48.05 61.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.749 -179.339 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.747 HD23 ' N ' ' A' ' 33' ' ' THR . 0.5 OUTLIER -60.19 -16.08 29.98 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.523 0.194 . . . . 0.0 111.523 -179.395 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.747 ' N ' HD23 ' A' ' 32' ' ' LEU . 88.6 m -90.18 -26.63 20.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.659 0.266 . . . . 0.0 111.115 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.5 mt -87.32 -46.72 9.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.398 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 68.8 mtp180 -74.22 -5.49 42.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.794 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.497 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -97.97 25.29 6.14 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.757 0.313 . . . . 0.0 111.438 -179.661 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.471 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 53.6 pttt 46.53 29.96 1.01 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.24 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -90.25 130.55 41.56 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.791 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -75.89 148.94 32.56 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.442 2.095 . . . . 0.0 112.422 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.489 HD13 ' SG ' ' A' ' 59' ' ' CYS . 16.0 mt -90.59 142.24 27.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.888 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.429 ' HB2' ' CE1' ' A' ' 44' ' ' PHE . 1.6 m-20 -73.71 157.25 87.72 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.03 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.6 -9.76 26.47 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.604 2.203 . . . . 0.0 112.557 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -96.23 30.97 2.31 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.766 0.317 . . . . 0.0 110.94 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.439 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.3 m-30 -100.42 -11.17 20.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.305 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 65.95 44.92 2.6 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.851 0.358 . . . . 0.0 110.925 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.9 p-10 -89.15 76.93 7.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.888 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -119.82 176.79 5.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.915 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.91 136.25 38.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.064 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.561 ' H ' HD12 ' A' ' 49' ' ' LEU . 2.5 mp -78.13 -172.69 2.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.914 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.0 mmtm -130.41 171.39 13.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.95 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.19 -128.17 11.47 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.5 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.7 mmtp -69.98 -23.25 63.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.705 0.288 . . . . 0.0 110.978 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 18.9 m-90 -96.68 31.82 2.22 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.889 0.376 . . . . 0.0 110.998 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.446 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.2 OUTLIER -66.12 -51.45 45.3 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.064 179.905 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 98.7 Cg_endo -80.09 46.56 2.27 Favored 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.422 2.081 . . . . 0.0 112.487 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -154.96 179.11 9.44 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.918 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 -139.69 138.98 36.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.872 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.434 ' HG3' HG22 ' A' ' 68' ' ' VAL . 2.1 tt0 -98.44 176.77 5.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.489 ' SG ' HD13 ' A' ' 40' ' ' LEU . 12.0 t -170.72 102.64 0.24 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.881 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.697 ' CD2' HD22 ' A' ' 66' ' ' LEU . 10.7 m170 -83.2 82.98 8.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.032 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.589 HG21 HG23 ' A' ' 30' ' ' VAL . 2.7 mp -61.65 -35.12 65.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.077 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.417 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 7.6 mmmt -131.03 169.32 14.02 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.673 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.417 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 16.9 Cg_exo -66.83 -5.29 12.95 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.634 2.223 . . . . 0.0 112.79 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -142.92 27.48 1.63 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.829 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.909 ' O ' HD23 ' A' ' 66' ' ' LEU . 98.0 t -135.52 137.98 48.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.177 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.909 HD23 ' O ' ' A' ' 65' ' ' VAL . 9.0 mt -139.86 93.79 2.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.794 179.559 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.64 HD12 ' N ' ' A' ' 68' ' ' VAL . 2.6 tp -92.36 119.24 31.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.844 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.64 ' N ' HD12 ' A' ' 67' ' ' LEU . 50.3 t -93.74 136.05 26.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.021 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.428 ' CZ ' ' HB2' ' A' ' 59' ' ' CYS . 2.2 p90 -147.8 158.61 44.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.759 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.741 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.4 OUTLIER -104.28 144.35 31.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.866 -179.968 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.521 ' HA ' HD12 ' A' ' 76' ' ' LEU . 8.7 p -82.83 158.96 3.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.021 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.506 ' N ' HG22 ' A' ' 71' ' ' VAL . 0.0 OUTLIER -157.44 155.84 31.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.926 179.599 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.67 107.29 0.49 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.003 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 58.29 23.41 10.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.116 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -158.1 154.66 27.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.886 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.521 HD12 ' HA ' ' A' ' 71' ' ' VAL . 4.6 tp -133.89 140.24 46.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.723 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.741 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.0 pp -122.64 134.61 65.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.189 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 71.3 mt -74.19 151.94 39.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.912 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.735 HD12 HH11 ' A' ' 80' ' ' ARG . 0.2 OUTLIER -112.62 -68.62 0.92 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.884 179.976 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.735 HH11 HD12 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -158.62 168.81 25.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.078 179.999 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.659 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.3 tm? -118.63 133.95 55.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.733 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.659 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -150.3 -164.57 11.96 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.58 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.4 p -144.48 171.78 13.88 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.724 0.297 . . . . 0.0 110.832 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.579 ' HA ' HD11 ' A' ' 66' ' ' LEU . 2.5 t-80 -58.65 -28.33 65.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.016 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.2 t -86.38 -30.05 22.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.94 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.37 -74.93 0.31 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.906 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.745 HD12 ' HB2' ' A' ' 66' ' ' LEU . 34.7 mt -60.25 -34.61 73.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.854 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.85 179.982 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 mtp . . . . . 0 N--CA 1.488 1.435 0 CA-C-O 120.851 0.358 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.1 mt 60.35 -171.14 0.14 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.98 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.66 156.47 13.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.908 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.789 HD11 HD11 ' A' ' 78' ' ' LEU . 7.1 tt -124.68 151.37 45.03 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.977 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.662 ' HB2' HG22 ' A' ' 77' ' ' ILE . 1.4 t-20 -138.13 174.28 10.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.852 179.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.0 mt -127.67 142.58 51.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.871 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.5 mmpt? -112.93 164.55 13.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.907 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.3 pttt -54.71 -53.21 57.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.183 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.41 ' CB ' ' HB3' ' A' ' 80' ' ' ARG . 55.8 m -57.62 -37.68 73.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.121 -179.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.471 ' CZ ' HD13 ' A' ' 78' ' ' LEU . 36.0 t80 -62.45 -27.69 69.29 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.99 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -77.7 -38.47 47.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.092 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.412 ' O ' ' CB ' ' A' ' 16' ' ' LYS . 6.1 ptmt -89.96 -8.59 51.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.601 -179.778 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -90.44 -23.52 20.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.792 0.33 . . . . 0.0 111.116 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.591 ' HZ ' HD13 ' A' ' 27' ' ' LEU . 37.1 t80 -90.29 -68.86 0.76 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.439 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -49.96 -33.07 16.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.995 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.412 ' CB ' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -79.45 -23.66 42.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.862 179.715 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.454 ' HG ' ' CG ' ' A' ' 22' ' ' PHE . 36.6 tp -86.46 -50.53 6.81 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.689 HD13 ' HD2' ' A' ' 22' ' ' PHE . 4.2 mm? -50.55 -36.08 32.77 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.1 179.749 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 27.0 mt -90.01 -7.75 53.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.798 -179.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -93.77 35.85 1.12 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.877 0.37 . . . . 0.0 111.149 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 80.11 22.85 62.42 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.684 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.689 ' HD2' HD13 ' A' ' 18' ' ' LEU . 71.7 t80 -98.72 107.96 20.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.783 0.325 . . . . 0.0 110.609 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.751 ' HB3' HG23 ' A' ' 26' ' ' VAL . 2.2 t0 -52.77 124.13 13.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.037 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.58 ' HA ' HD23 ' A' ' 27' ' ' LEU . 7.4 p-10 -62.43 -38.4 89.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.119 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.6 t -54.1 -24.59 18.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.245 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.751 HG23 ' HB3' ' A' ' 23' ' ' ASP . 34.5 t -79.61 -35.48 16.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.286 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.591 HD13 ' HZ ' ' A' ' 14' ' ' PHE . 1.0 OUTLIER -57.67 -35.99 71.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.954 -179.871 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.734 ' O ' HD22 ' A' ' 32' ' ' LEU . 6.1 t-20 -63.7 -15.86 59.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.36 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -90.1 -35.58 15.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.694 0.283 . . . . 0.0 111.328 -179.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.765 ' CG2' HD13 ' A' ' 61' ' ' ILE . 10.0 p -90.63 -36.05 7.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -179.325 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.643 ' CD1' HG13 ' A' ' 30' ' ' VAL . 1.6 mp -76.21 -42.07 37.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 111.642 0.238 . . . . 0.0 111.642 -179.163 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.761 HD23 ' N ' ' A' ' 33' ' ' THR . 0.4 OUTLIER -64.51 -14.37 56.97 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.447 -179.553 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.761 ' N ' HD23 ' A' ' 32' ' ' LEU . 99.9 m -90.36 -25.68 20.32 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 120.767 0.317 . . . . 0.0 110.904 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.8 mt -86.3 -36.78 19.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.555 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.6 mtp-105 -93.5 20.36 7.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.643 -179.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.54 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -126.85 18.71 7.24 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.598 0.222 . . . . 0.0 111.598 -179.793 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.458 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 12.4 pttm 45.72 30.01 0.76 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.907 0.384 . . . . 0.0 111.085 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.02 148.13 78.11 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.9 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -74.44 161.4 40.19 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.5 2.133 . . . . 0.0 112.463 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.2 mt -130.14 123.4 30.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.991 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.61 156.91 29.86 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.914 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -62.34 -24.17 75.63 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.543 2.162 . . . . 0.0 112.281 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.51 -23.7 67.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.037 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.423 ' O ' ' CD2' ' A' ' 60' ' ' HIS . 44.6 m-85 -69.34 -10.54 58.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.455 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 58.91 34.69 23.79 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.861 0.362 . . . . 0.0 111.066 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -66.4 78.11 0.1 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.837 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 73.1 m80 -138.95 177.62 7.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.019 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.31 137.02 44.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.09 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.537 HD13 ' HB3' ' A' ' 53' ' ' TRP . 0.4 OUTLIER -74.89 -171.09 1.22 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.819 179.906 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -144.1 149.78 37.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.929 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 65.98 109.17 0.01 OUTLIER Glycine 0 CA--C 1.506 -0.474 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.841 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.4 mptt 69.18 -45.95 0.56 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.528 0.204 . . . . 0.0 111.181 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.537 ' HB3' HD13 ' A' ' 49' ' ' LEU . 17.8 m95 -101.95 33.93 2.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.855 0.359 . . . . 0.0 111.073 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.464 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 22.9 tttm -64.15 -49.42 73.66 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.303 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.464 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 89.1 Cg_endo -79.76 46.89 2.35 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.362 2.041 . . . . 0.0 112.745 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.551 ' CE1' HD11 ' A' ' 79' ' ' LEU . 69.1 m-85 -153.02 -176.51 5.8 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.732 0.301 . . . . 0.0 110.962 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.407 ' HB2' ' NH1' ' A' ' 57' ' ' ARG . 18.5 ttm105 -137.33 141.99 41.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.153 -179.749 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -106.81 161.97 14.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.793 179.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 9.1 t -171.27 100.24 0.2 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.906 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.44 ' O ' ' CG ' ' A' ' 60' ' ' HIS . 26.8 p80 -86.58 108.56 18.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.067 0.461 . . . . 0.0 110.827 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.765 HD13 ' CG2' ' A' ' 30' ' ' VAL . 4.6 mp -77.53 -31.9 18.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.852 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.538 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 5.6 mmtp -128.05 161.5 55.61 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.293 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.538 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 29.0 Cg_endo -62.98 -6.02 8.73 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.307 2.005 . . . . 0.0 112.747 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -135.84 25.81 3.34 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.694 179.556 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.863 ' O ' HD23 ' A' ' 66' ' ' LEU . 54.8 t -137.33 146.76 27.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.137 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.863 HD23 ' O ' ' A' ' 65' ' ' VAL . 4.7 mt -144.25 102.94 3.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.731 179.6 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.649 ' C ' HD13 ' A' ' 67' ' ' LEU . 3.3 tm? -92.58 131.19 37.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.008 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.604 ' N ' HD13 ' A' ' 67' ' ' LEU . 87.5 t -109.84 115.59 50.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.828 178.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.485 ' HB3' HD11 ' A' ' 67' ' ' LEU . 27.2 p90 -128.19 149.96 50.22 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.268 -179.073 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.793 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.4 OUTLIER -113.73 155.23 25.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.857 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.578 ' H ' HD23 ' A' ' 70' ' ' LEU . 21.5 t -107.04 129.95 59.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.176 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.47 173.2 7.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.784 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -56.92 101.93 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.912 0.387 . . . . 0.0 110.981 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 54.85 23.48 4.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.149 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -150.68 133.91 16.2 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.938 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.464 HD12 ' HA ' ' A' ' 71' ' ' VAL . 6.6 tp -105.04 152.09 23.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.755 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.793 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.0 pp -138.29 142.89 34.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.429 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.789 HD11 HD11 ' A' ' 4' ' ' LEU . 58.1 mt -93.81 123.31 37.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.434 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.589 HD11 HD12 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -77.44 -60.37 2.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.078 -179.635 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.41 ' HB3' ' CB ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -173.87 167.05 4.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.081 0.467 . . . . 0.0 111.65 179.949 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.898 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.9 tm? -116.8 143.52 45.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.582 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.898 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -165.93 -165.63 23.59 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.841 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.0 p -138.84 -178.84 5.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.764 0.316 . . . . 0.0 110.795 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -62.89 -23.42 67.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.182 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.7 m -83.29 -30.19 27.76 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.163 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -86.03 -67.95 0.77 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.014 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.485 HD13 HD12 ' A' ' 66' ' ' LEU . 4.6 mp -56.15 -32.39 64.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.055 -179.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.941 -179.96 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.306 0 CA-C-O 120.784 0.326 . . . . 0.0 111.188 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 7.1 mt -98.24 153.51 18.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.835 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.61 145.95 50.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.824 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -113.59 151.43 31.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.945 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.829 ' HB2' HG22 ' A' ' 77' ' ' ILE . 2.7 t30 -137.13 -173.01 3.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.764 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.0 mp -144.73 136.84 26.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.976 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.55 172.7 6.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.938 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.2 mtmt -67.96 -46.16 72.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.949 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 35.3 m -59.69 -42.41 92.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.872 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.509 ' CE1' HD13 ' A' ' 67' ' ' LEU . 11.5 t80 -60.54 -36.85 79.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.746 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -63.53 -47.47 81.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.845 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.578 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 9.7 mttt -72.6 -23.47 60.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.102 0.477 . . . . 0.0 111.027 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.428 ' C ' ' HB2' ' A' ' 17' ' ' LEU . 82.7 m-20 -90.41 -10.28 44.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.057 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.559 ' O ' HD21 ' A' ' 18' ' ' LEU . 10.1 t80 -90.85 -68.4 0.79 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.904 179.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -91.38 -36.7 13.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.214 -179.489 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.578 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 2.1 ttmt -76.21 -16.58 59.8 Favored 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 120.89 -0.324 . . . . 0.0 111.689 -178.709 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.431 HD22 ' HB2' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -81.88 -35.31 29.4 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.137 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.821 HD13 ' CB ' ' A' ' 24' ' ' ASP . 1.4 mt -61.53 -35.76 78.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.952 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 pp -89.93 11.58 20.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.348 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -114.06 28.69 8.56 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.859 0.362 . . . . 0.0 110.945 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.04 25.03 32.84 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.647 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.441 ' CD2' ' N ' ' A' ' 23' ' ' ASP . 50.9 t80 -115.09 164.22 14.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.775 0.321 . . . . 0.0 110.872 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.633 ' HB3' HG23 ' A' ' 26' ' ' VAL . 11.9 t70 -98.65 114.99 27.69 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.965 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.821 ' CB ' HD13 ' A' ' 18' ' ' LEU . 6.8 p-10 -66.44 -31.16 71.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.893 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.1 t -56.7 -37.0 70.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.186 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.633 HG23 ' HB3' ' A' ' 23' ' ' ASP . 46.9 t -60.76 -35.71 66.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.204 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.442 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.6 OUTLIER -65.48 -33.76 76.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.791 -179.815 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.819 ' O ' HD22 ' A' ' 32' ' ' LEU . 8.1 t-20 -65.9 -14.38 61.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.4 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.445 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 3.1 mt-10 -90.14 -33.76 16.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.731 0.301 . . . . 0.0 111.113 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 1.13 HG23 HG21 ' A' ' 61' ' ' ILE . 8.0 p -90.82 -43.06 14.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.659 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.753 HD12 HG13 ' A' ' 30' ' ' VAL . 1.6 mp -62.26 -57.73 10.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.639 -179.248 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.819 HD22 ' O ' ' A' ' 28' ' ' ASN . 0.9 OUTLIER -49.55 -21.43 0.98 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -178.855 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.669 ' N ' HD23 ' A' ' 32' ' ' LEU . 89.1 m -90.08 -34.23 16.0 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.676 0.274 . . . . 0.0 111.24 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.85 HD21 HD21 ' A' ' 40' ' ' LEU . 83.0 mt -86.43 -30.84 21.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.668 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.491 ' HG3' HG23 ' A' ' 31' ' ' ILE . 2.2 mtt85 -92.38 20.18 6.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.745 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.591 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -113.74 -50.94 2.82 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.796 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.543 ' H ' ' HG3' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 153.93 -20.65 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 122.699 0.4 . . . . 0.0 111.008 179.752 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.458 ' OE1' HG23 ' A' ' 33' ' ' THR . 24.4 tt0 -64.08 111.44 5.44 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.173 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -78.82 131.48 10.19 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.508 2.139 . . . . 0.0 112.273 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.85 HD21 HD21 ' A' ' 34' ' ' LEU . 6.7 mt -59.57 166.95 2.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.926 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -108.73 163.28 17.33 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.09 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.94 -12.75 31.08 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.618 2.212 . . . . 0.0 112.545 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 -82.91 2.95 31.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.374 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -95.23 20.97 8.47 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.708 0.29 . . . . 0.0 111.185 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 61.18 46.72 7.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.897 0.379 . . . . 0.0 111.037 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.4 p-10 -89.52 96.61 10.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.937 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 21.6 p-80 -152.08 -178.07 6.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.931 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -87.02 128.48 35.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.13 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.599 ' H ' HD12 ' A' ' 49' ' ' LEU . 4.6 mp -65.62 -175.78 0.3 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.889 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.1 mtmt -117.34 161.19 19.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.898 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.95 -116.52 4.68 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.575 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.14 -14.75 21.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.601 0.239 . . . . 0.0 111.313 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 19.3 m95 -96.24 31.08 2.28 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.061 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.4 OUTLIER -75.53 -51.44 3.2 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.028 179.844 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 50.9 Cg_exo -54.01 -18.69 13.83 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.424 2.082 . . . . 0.0 112.437 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -98.89 175.07 6.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.854 0.359 . . . . 0.0 110.992 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.653 HH21 HG21 ' A' ' 71' ' ' VAL . 0.3 OUTLIER -128.61 132.54 48.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.877 179.888 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.447 ' HG3' HD21 ' A' ' 49' ' ' LEU . 2.4 tt0 -95.96 172.76 7.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.072 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 3.2 t -170.18 116.19 0.52 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.638 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.6 m170 -88.57 84.62 6.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.111 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 1.13 HG21 HG23 ' A' ' 30' ' ' VAL . 3.5 mp -59.05 -27.89 37.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.85 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.439 ' HB2' HG23 ' A' ' 65' ' ' VAL . 7.1 mttp -139.62 168.92 13.47 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.538 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.418 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 17.2 Cg_exo -66.92 -2.93 8.65 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.653 2.235 . . . . 0.0 112.884 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -145.42 29.56 1.15 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.914 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.88 ' O ' HD23 ' A' ' 66' ' ' LEU . 42.2 t -139.6 151.25 22.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.215 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.88 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.0 OUTLIER -157.09 104.09 2.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.595 179.812 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.509 HD13 ' CE1' ' A' ' 10' ' ' PHE . 1.1 tp -105.2 116.65 32.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.669 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.446 HG22 ' HG3' ' A' ' 58' ' ' GLU . 34.1 t -85.43 141.86 13.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.222 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.637 ' CD1' HD11 ' A' ' 76' ' ' LEU . 38.3 p90 -147.41 163.6 35.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.963 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.762 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.3 OUTLIER -112.82 157.14 21.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.867 179.98 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.663 ' H ' HD23 ' A' ' 70' ' ' LEU . 21.5 t -111.44 115.02 48.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.099 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.1 163.62 16.13 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.857 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -42.75 -35.61 1.2 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.55 -179.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -156.62 26.53 0.34 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.084 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -149.37 155.88 41.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.768 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.637 HD11 ' CD1' ' A' ' 69' ' ' TYR . 9.8 tp -113.73 132.16 55.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.723 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.829 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.2 pp -126.3 130.39 71.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.367 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 72.7 mt -74.13 142.18 45.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.637 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.82 -75.55 0.56 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.169 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.5 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -146.95 179.6 7.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.84 0.352 . . . . 0.0 111.287 -179.724 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.597 ' C ' HD13 ' A' ' 81' ' ' LEU . 2.9 tm? -139.6 134.9 32.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.765 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.516 ' H ' HD22 ' A' ' 81' ' ' LEU . . . -179.73 176.53 47.62 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.586 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.435 ' C ' HD11 ' A' ' 66' ' ' LEU . 14.6 m -112.42 175.32 5.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.829 0.347 . . . . 0.0 110.827 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.57 ' N ' HD11 ' A' ' 66' ' ' LEU . 46.7 t-80 -59.79 -32.04 70.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.852 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -78.77 -21.32 48.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.045 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.15 -49.69 6.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.833 0.349 . . . . 0.0 110.845 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.6 HD12 HD12 ' A' ' 66' ' ' LEU . 12.4 mt -82.4 -40.94 20.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.977 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.935 -179.964 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.9 ttp . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 120.77 0.319 . . . . 0.0 111.535 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.93 HD12 ' HB2' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -129.92 158.34 39.78 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.895 179.981 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.45 152.53 21.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.029 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 7.7 tt -128.54 138.43 52.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.744 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.688 ' HB2' HG22 ' A' ' 77' ' ' ILE . 4.9 t30 -119.59 179.06 4.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.987 -179.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.454 HD11 ' NH2' ' A' ' 35' ' ' ARG . 0.6 OUTLIER -147.08 122.74 10.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.818 179.974 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.528 ' NZ ' HD13 ' A' ' 77' ' ' ILE . 8.4 mttp -103.17 169.3 8.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.871 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 7.0 tttt -65.83 -43.58 88.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.855 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.5 m -58.76 -29.88 67.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.974 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.551 ' HE1' HD13 ' A' ' 67' ' ' LEU . 38.7 t80 -77.14 -41.56 41.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.949 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -58.82 -45.13 90.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.866 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.476 ' O ' ' N ' ' A' ' 16' ' ' LYS . 2.7 mmmt -73.51 -45.06 56.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.026 0.441 . . . . 0.0 110.717 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.58 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -49.3 -25.76 2.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.982 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.617 ' CE1' HD22 ' A' ' 27' ' ' LEU . 75.9 t80 -91.49 -72.47 0.58 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.033 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.553 ' HA ' HD12 ' A' ' 18' ' ' LEU . 9.1 t70 -51.01 -45.3 61.16 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.357 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.476 ' N ' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -72.94 -13.5 61.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.36 -179.853 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.58 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 5.6 mt -90.34 -53.49 4.43 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 121.025 0.44 . . . . 0.0 110.356 179.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.553 HD12 ' HA ' ' A' ' 15' ' ' ASP . 0.5 OUTLIER -52.32 -33.87 44.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.219 -179.855 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.654 ' O ' HD12 ' A' ' 19' ' ' LEU . 4.3 pp -90.06 13.94 13.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.237 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -123.79 13.29 9.24 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.556 0.217 . . . . 0.0 111.406 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.41 29.16 5.77 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.787 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -110.73 118.13 35.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.888 0.375 . . . . 0.0 110.779 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.717 ' HB3' HG23 ' A' ' 26' ' ' VAL . 1.2 t70 -58.51 119.89 7.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.871 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.597 ' HA ' HD23 ' A' ' 27' ' ' LEU . 3.5 p-10 -66.17 -30.3 70.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.952 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 94.1 p -57.23 -27.51 62.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.153 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.717 HG23 ' HB3' ' A' ' 23' ' ' ASP . 31.4 t -71.96 -37.83 62.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.336 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.617 HD22 ' CE1' ' A' ' 14' ' ' PHE . 1.0 OUTLIER -59.76 -34.94 73.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.02 -179.819 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.533 ' O ' HD22 ' A' ' 32' ' ' LEU . 6.0 t-20 -61.25 -18.15 56.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.283 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.413 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 51.1 mt-10 -88.98 -35.76 16.22 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.78 0.324 . . . . 0.0 111.331 -179.759 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.916 HG13 HD12 ' A' ' 31' ' ' ILE . 15.0 p -90.69 -31.13 5.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.932 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.916 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -75.35 -47.98 32.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.658 -179.364 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.623 HD23 ' N ' ' A' ' 33' ' ' THR . 0.6 OUTLIER -56.34 -22.69 32.48 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.134 -179.539 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.623 ' N ' HD23 ' A' ' 32' ' ' LEU . 94.4 m -85.39 -27.39 25.84 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.673 0.273 . . . . 0.0 111.208 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.2 mt -84.64 -33.72 23.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.312 -179.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.454 ' NH2' HD11 ' A' ' 6' ' ' LEU . 1.0 OUTLIER -96.68 20.35 10.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.303 -179.89 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.542 ' O ' ' HG3' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -119.29 27.08 9.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.409 -179.768 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.542 ' HG3' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 35.6 36.14 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.67 -179.906 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -102.79 132.71 20.96 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.667 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -74.66 138.31 23.75 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.407 2.071 . . . . 0.0 112.524 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 6.0 mt -88.22 134.49 33.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.702 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -61.79 152.94 74.19 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.007 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.64 -8.25 23.18 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.532 2.155 . . . . 0.0 112.682 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.14 6.76 27.76 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.344 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -90.02 9.12 29.21 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.583 0.23 . . . . 0.0 111.316 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 36.2 mm-40 57.77 41.01 25.73 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.939 0.399 . . . . 0.0 111.057 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -87.54 86.56 7.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.984 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -139.84 -172.0 3.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.952 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.58 148.77 44.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.199 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.46 HD13 ' HB2' ' A' ' 56' ' ' PHE . 1.7 mp -84.74 177.68 7.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.875 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.18 156.76 22.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.89 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.95 -131.46 10.75 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.609 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.42 -13.92 50.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.56 0.219 . . . . 0.0 111.276 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 8.9 m95 -95.49 23.83 5.68 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.661 0.267 . . . . 0.0 111.291 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.463 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.4 OUTLIER -60.67 -49.16 90.95 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.047 179.988 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.463 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 36.9 Cg_exo -57.42 -16.85 24.73 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.449 2.099 . . . . 0.0 112.43 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.46 ' HB2' HD13 ' A' ' 49' ' ' LEU . 96.7 m-85 -93.3 176.31 6.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.867 0.365 . . . . 0.0 111.02 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.527 ' O ' HG13 ' A' ' 68' ' ' VAL . 22.2 ttm180 -132.29 137.88 47.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.899 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.406 ' HG3' HG22 ' A' ' 68' ' ' VAL . 3.8 tt0 -95.91 176.19 6.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.046 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 3.0 t -169.06 107.01 0.43 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.888 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.566 ' CE1' HD22 ' A' ' 66' ' ' LEU . 7.0 m170 -92.08 77.4 5.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.847 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.525 ' H ' HD12 ' A' ' 61' ' ' ILE . 4.3 mp -58.28 -28.97 36.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.061 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.402 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 1.3 mtpm? -139.06 169.47 12.38 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.875 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.402 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 11.3 Cg_exo -70.7 -2.47 10.9 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.77 2.313 . . . . 0.0 112.838 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -139.55 27.1 2.29 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.836 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.798 ' O ' HD23 ' A' ' 66' ' ' LEU . 46.2 t -140.13 149.97 21.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.016 0.436 . . . . 0.0 111.1 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.798 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.8 OUTLIER -148.6 91.46 1.89 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.608 179.87 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.739 HD12 ' N ' ' A' ' 68' ' ' VAL . 2.4 tp -91.42 122.76 34.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.962 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.739 ' N ' HD12 ' A' ' 67' ' ' LEU . 56.0 t -99.15 133.46 41.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.912 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.775 ' CD1' HD11 ' A' ' 76' ' ' LEU . 23.7 p90 -140.95 172.49 12.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.92 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.639 ' HB2' HD11 ' A' ' 77' ' ' ILE . 5.7 tp -118.5 136.12 54.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.872 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.515 HG22 ' N ' ' A' ' 72' ' ' LYS . 8.7 p -80.67 159.29 4.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.172 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.515 ' N ' HG22 ' A' ' 71' ' ' VAL . 0.0 OUTLIER -143.75 156.54 44.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.895 179.381 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -40.9 -32.3 0.22 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.837 -179.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -165.6 33.57 0.05 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.759 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -156.67 163.5 39.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.949 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.93 ' HB2' HD12 ' A' ' 2' ' ' LEU . 11.8 tp -125.9 139.62 53.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.712 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.688 HG22 ' HB2' ' A' ' 5' ' ' ASN . 1.8 pp -129.46 129.8 67.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.171 -179.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.542 HD13 ' CE2' ' A' ' 10' ' ' PHE . 66.8 mt -73.29 146.22 45.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.882 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.425 ' HG ' ' CD2' ' A' ' 56' ' ' PHE . 0.1 OUTLIER -112.98 -70.75 0.79 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.009 -179.891 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.87 157.48 37.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.041 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.581 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.4 tm? -111.49 133.7 53.59 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.032 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.581 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -136.99 -167.91 11.24 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.371 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.6 m -151.13 162.23 41.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.844 0.354 . . . . 0.0 110.795 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -55.75 -28.0 53.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.752 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 64.8 m -89.93 -27.43 19.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.826 179.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.06 -70.91 0.47 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.987 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.584 HD12 ' HB2' ' A' ' 66' ' ' LEU . 17.9 mt -68.81 -37.07 78.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.967 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.884 179.968 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 mtp . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.846 0.355 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.465 HD12 ' CB ' ' A' ' 76' ' ' LEU . 0.1 OUTLIER -151.23 162.7 40.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.845 179.968 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.63 150.51 32.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.973 -179.958 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.646 HD11 HD11 ' A' ' 78' ' ' LEU . 9.0 tt -119.33 148.08 43.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.833 179.945 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.743 ' HB2' HG22 ' A' ' 77' ' ' ILE . 4.9 t30 -135.14 -177.58 4.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.9 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.512 HD11 ' NH2' ' A' ' 35' ' ' ARG . 17.2 mt -146.73 133.6 20.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.975 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.4 mmmt -104.34 174.76 5.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.969 179.94 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.7 tttm -64.98 -33.11 75.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.951 -179.975 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 m -69.52 -46.62 66.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.972 179.96 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.612 ' CE1' HD13 ' A' ' 67' ' ' LEU . 23.5 t80 -59.74 -30.08 68.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.98 -179.994 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.0 mm-40 -60.42 -46.12 91.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.0 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.499 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 0.7 OUTLIER -73.85 -19.85 60.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.047 0.451 . . . . 0.0 111.174 -179.993 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.426 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 74.2 m-20 -90.46 -16.96 27.99 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.984 179.708 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.589 ' O ' HD13 ' A' ' 18' ' ' LEU . 20.4 t80 -90.99 -68.54 0.78 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.434 -179.506 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.801 ' HA ' HD22 ' A' ' 18' ' ' LEU . 38.8 t70 -91.01 -40.51 11.61 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -178.903 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.499 ' HB3' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -70.89 -24.8 62.55 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.35 -178.979 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.426 ' HB2' ' HA ' ' A' ' 13' ' ' ASP . 27.4 tp -72.54 -34.47 67.56 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 179.151 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.801 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.1 OUTLIER -57.63 -31.11 65.92 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.733 179.859 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 14.4 mt -89.97 -6.56 55.53 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.442 -179.984 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.68 28.3 3.48 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.732 0.301 . . . . 0.0 111.105 -179.861 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 92.89 23.05 26.43 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.814 179.804 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.502 ' CD1' HD12 ' A' ' 18' ' ' LEU . 11.1 t80 -113.79 135.44 53.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.857 0.361 . . . . 0.0 110.768 179.81 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.414 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 18.6 t0 -93.39 122.1 35.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.923 -179.98 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -58.3 -20.57 43.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.429 179.959 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 t -50.57 -55.42 16.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.732 0.301 . . . . 0.0 111.195 -179.88 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 37.9 t -67.2 -34.87 72.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.079 -179.952 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.839 ' CD1' HD13 ' A' ' 31' ' ' ILE . 5.4 tp -62.99 -29.93 71.2 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.715 179.949 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.581 ' O ' HD22 ' A' ' 32' ' ' LEU . 47.3 t30 -63.5 -22.88 67.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.212 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.481 ' HA ' HD22 ' A' ' 32' ' ' LEU . 3.6 mt-10 -87.07 -18.16 31.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.351 -179.896 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.708 HG13 HG21 ' A' ' 61' ' ' ILE . 66.3 t -90.26 -69.53 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.003 0.43 . . . . 0.0 111.613 -179.705 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.839 HD13 ' CD1' ' A' ' 27' ' ' LEU . 1.2 mp -48.42 -44.01 13.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.231 -178.975 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.583 HD23 ' N ' ' A' ' 33' ' ' THR . 0.4 OUTLIER -60.8 -15.94 35.4 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 121.079 -0.248 . . . . 0.0 111.568 -179.418 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.583 ' N ' HD23 ' A' ' 32' ' ' LEU . 85.7 m -90.08 -36.27 14.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.759 0.314 . . . . 0.0 111.025 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.9 mt -82.34 -29.61 30.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.331 -179.586 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.512 ' NH2' HD11 ' A' ' 6' ' ' LEU . 22.0 mtt180 -94.62 20.31 8.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.398 -179.76 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.474 ' O ' ' CG ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -126.68 26.76 6.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.068 -179.822 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.474 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 0.6 OUTLIER 47.33 53.67 10.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.178 -179.82 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -128.45 102.78 20.31 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.703 179.944 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -68.09 136.67 38.53 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.396 2.064 . . . . 0.0 112.341 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.625 HD13 ' SG ' ' A' ' 59' ' ' CYS . 1.2 mp -74.1 158.21 34.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.993 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.19 164.28 53.15 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.005 -179.909 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.53 -13.34 38.72 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.61 2.207 . . . . 0.0 112.487 179.941 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -86.89 7.49 27.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.421 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -93.53 14.17 19.61 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.109 179.941 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 58.76 38.69 24.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.91 0.386 . . . . 0.0 111.057 179.979 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.9 p-10 -83.62 79.74 9.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.892 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -137.43 176.11 9.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.94 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.69 152.45 37.51 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.143 -179.905 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.467 HD11 ' HG3' ' A' ' 58' ' ' GLU . 8.1 mt -97.15 -176.67 3.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.785 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -135.24 155.68 50.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.995 0.426 . . . . 0.0 110.899 -179.979 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 60.4 106.35 0.01 OUTLIER Glycine 0 CA--C 1.508 -0.387 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.704 179.951 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.53 -46.77 0.59 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.63 0.252 . . . . 0.0 111.074 179.939 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 62.3 m95 -99.63 33.33 2.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.823 0.344 . . . . 0.0 111.018 -179.881 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.44 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -71.63 -50.83 9.88 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.899 -179.948 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.44 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 14.1 Cg_exo -68.74 -7.08 19.55 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.639 2.226 . . . . 0.0 112.43 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.464 ' CD2' HD13 ' A' ' 70' ' ' LEU . 69.5 m-85 -102.2 178.3 4.64 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.949 0.404 . . . . 0.0 111.071 -179.785 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.627 ' O ' HG13 ' A' ' 68' ' ' VAL . 0.1 OUTLIER -137.47 144.64 42.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.726 -179.984 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.545 ' HG3' HG22 ' A' ' 68' ' ' VAL . 1.5 tt0 -107.18 168.57 9.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.998 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.625 ' SG ' HD13 ' A' ' 40' ' ' LEU . 15.0 t -168.33 123.8 0.98 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.896 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 9.1 m170 -93.28 93.17 8.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.97 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.708 HG21 HG13 ' A' ' 30' ' ' VAL . 4.4 mp -60.1 -31.56 48.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.861 179.895 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.442 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 6.1 mtpp -145.89 172.5 5.21 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.622 -179.932 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.442 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 17.4 Cg_exo -66.38 -4.29 10.39 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.672 2.248 . . . . 0.0 112.856 -179.888 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -142.02 29.07 1.68 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.861 179.792 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.518 ' C ' HD23 ' A' ' 66' ' ' LEU . 61.2 t -149.39 143.29 18.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.257 -180.0 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.789 HD12 HD13 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -159.13 118.71 3.03 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.683 179.961 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.612 HD13 ' CE1' ' A' ' 10' ' ' PHE . 0.2 OUTLIER -120.48 136.69 54.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.85 0.357 . . . . 0.0 110.968 -179.934 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.627 HG13 ' O ' ' A' ' 57' ' ' ARG . 57.1 t -91.53 137.13 22.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.894 -179.958 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -135.49 172.95 12.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.858 179.934 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.78 ' HB2' HD11 ' A' ' 77' ' ' ILE . 5.0 tp -117.23 162.23 18.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.905 -179.971 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.6 t -106.03 113.38 42.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.12 179.967 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -109.28 159.82 16.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.89 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -58.6 106.44 0.4 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.9 179.969 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.5 t70 57.4 26.59 12.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.101 -179.809 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -157.78 148.7 21.13 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.855 -179.988 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.465 ' CB ' HD12 ' A' ' 2' ' ' LEU . 7.6 tp -120.72 138.12 54.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.834 179.974 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.78 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.2 pp -124.84 135.61 63.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.198 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.646 HD11 HD11 ' A' ' 4' ' ' LEU . 58.4 mt -80.04 142.78 34.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.735 179.789 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.415 ' HG ' ' CD2' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -103.89 -71.69 0.72 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.06 -179.789 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.91 161.07 40.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.882 0.373 . . . . 0.0 111.349 -179.841 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.705 HD22 ' N ' ' A' ' 82' ' ' GLY . 1.7 tm? -123.73 133.44 53.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.635 179.911 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.705 ' N ' HD22 ' A' ' 81' ' ' LEU . . . -155.03 -176.95 27.82 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.572 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.7 t -121.5 172.31 8.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.803 0.335 . . . . 0.0 110.936 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -60.06 -28.41 67.77 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.873 179.988 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 49.3 p -82.86 -21.62 34.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.157 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.68 -66.81 0.86 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.809 0.338 . . . . 0.0 111.015 -179.827 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.789 HD13 HD12 ' A' ' 66' ' ' LEU . 6.7 mp -57.69 -37.15 72.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.084 -179.818 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.86 -179.934 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.2 mmm . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.849 0.357 . . . . 0.0 111.171 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 6.6 mt 59.95 167.71 0.07 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.964 179.981 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.89 150.54 45.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.863 179.875 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.741 HD11 HD11 ' A' ' 78' ' ' LEU . 7.6 tt -119.51 150.16 40.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.971 179.957 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.768 ' HB2' HG22 ' A' ' 77' ' ' ILE . 2.9 t30 -136.47 170.38 16.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.918 179.989 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 39.4 mt -131.18 117.76 19.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.798 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -87.61 165.68 15.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.947 179.911 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.0 mttt -66.89 -40.12 87.67 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.83 -179.973 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.9 t -58.96 -35.77 73.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.965 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 39.7 t80 -61.42 -30.16 70.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.008 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -75.95 -33.98 59.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.92 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.434 ' O ' ' CB ' ' A' ' 16' ' ' LYS . 60.6 mttt -89.98 -14.16 34.6 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.199 179.853 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.456 ' O ' ' CB ' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -90.31 -21.18 22.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.971 0.415 . . . . 0.0 110.434 179.394 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.506 ' O ' HD12 ' A' ' 18' ' ' LEU . 40.8 t80 -91.4 -74.65 0.5 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.951 179.461 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.552 ' HA ' HD12 ' A' ' 18' ' ' LEU . 0.2 OUTLIER -51.07 -47.99 61.69 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.781 -179.967 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.442 ' HA ' HD21 ' A' ' 19' ' ' LEU . 1.6 tppt? -71.87 -13.3 61.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.69 -179.455 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.463 ' HG ' ' CB ' ' A' ' 22' ' ' PHE . 28.3 tp -90.64 -51.31 5.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.933 0.397 . . . . 0.0 110.348 179.837 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.552 HD12 ' HA ' ' A' ' 15' ' ' ASP . 0.4 OUTLIER -55.76 -34.63 65.38 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.344 -179.904 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.575 ' C ' HD12 ' A' ' 19' ' ' LEU . 4.0 pp -80.81 -10.7 59.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.224 179.874 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.12 23.14 6.79 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.732 0.301 . . . . 0.0 111.203 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.73 42.36 7.78 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.725 179.806 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.467 ' HB3' ' HA ' ' A' ' 18' ' ' LEU . 89.2 t80 -114.5 122.49 46.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.823 0.344 . . . . 0.0 110.879 179.814 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.475 ' HB3' HG23 ' A' ' 26' ' ' VAL . 1.1 t70 -61.32 103.39 0.3 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.838 -179.979 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.868 ' HA ' HD23 ' A' ' 27' ' ' LEU . 3.1 p30 -64.01 -24.42 67.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.128 -179.914 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.2 m -61.68 -47.52 84.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.236 -179.77 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.475 HG23 ' HB3' ' A' ' 23' ' ' ASP . 39.9 t -56.03 -43.89 76.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.313 -179.682 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.868 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.4 OUTLIER -59.83 -30.4 68.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.825 -179.963 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.679 ' O ' HD22 ' A' ' 32' ' ' LEU . 5.2 t-20 -53.45 -32.01 48.05 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.677 179.835 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.456 ' C ' HD22 ' A' ' 32' ' ' LEU . 1.7 mm-40 -75.71 -20.24 58.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.865 179.677 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.828 HG21 HG11 ' A' ' 65' ' ' VAL . 87.0 t -90.52 -74.0 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.761 -179.695 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.6 mp -44.11 -45.53 2.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.452 -178.985 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.821 HD23 ' N ' ' A' ' 33' ' ' THR . 0.4 OUTLIER -58.92 -16.69 18.91 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.864 -0.334 . . . . 0.0 111.531 -179.453 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.821 ' N ' HD23 ' A' ' 32' ' ' LEU . 65.2 m -90.0 -27.63 19.63 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 120.79 0.328 . . . . 0.0 110.785 179.689 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 30.1 mt -85.92 -33.42 21.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.241 -179.728 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.0 mtm180 -94.69 20.28 8.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.4 -179.74 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.442 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.1 OUTLIER -122.72 22.3 9.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.374 -179.867 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.434 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 0.6 OUTLIER 45.38 45.83 10.22 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.293 -179.946 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -117.46 127.97 26.32 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.798 -179.992 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.51 154.58 55.31 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.436 2.09 . . . . 0.0 112.257 -179.983 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.535 HD22 ' SG ' ' A' ' 59' ' ' CYS . 3.5 mp -102.46 146.32 28.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.92 179.972 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -66.79 158.58 79.48 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.922 179.918 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.51 -29.05 53.26 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.51 2.14 . . . . 0.0 112.18 179.949 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.36 -20.42 62.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.062 179.966 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.498 ' CE2' HD23 ' A' ' 40' ' ' LEU . 4.0 m-85 -61.3 -23.52 65.76 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.035 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 62.05 42.19 10.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.955 -179.991 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -75.54 84.08 2.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.845 179.932 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -134.02 -168.67 2.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.87 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -84.33 138.29 32.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.251 179.931 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.448 HD11 ' HB2' ' A' ' 58' ' ' GLU . 3.0 mp -76.75 -174.15 2.91 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.837 179.966 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.4 mttm -125.23 153.71 42.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.879 179.962 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 96.32 -113.71 4.74 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.644 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.1 -19.56 20.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.602 0.239 . . . . 0.0 111.15 -179.871 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.412 ' HB2' ' HB2' ' A' ' 49' ' ' LEU . 36.3 m95 -96.37 30.64 2.46 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.87 0.367 . . . . 0.0 110.945 -179.963 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.535 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 2.6 mtpt -69.48 -54.77 10.49 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.536 -179.874 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 21.7 Cg_endo -61.37 -10.42 15.89 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.293 1.995 . . . . 0.0 112.788 -179.799 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.611 ' CE1' HD21 ' A' ' 79' ' ' LEU . 47.4 m-85 -104.75 172.31 6.86 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.874 0.368 . . . . 0.0 110.918 179.818 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.419 ' O ' HG13 ' A' ' 68' ' ' VAL . 1.3 ttm180 -120.31 158.29 27.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.783 -179.813 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.448 ' HB2' HD11 ' A' ' 49' ' ' LEU . 6.8 tp10 -123.95 162.96 22.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.036 -179.92 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.535 ' SG ' HD22 ' A' ' 40' ' ' LEU . 1.1 t -154.97 112.24 3.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.754 179.933 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 9.1 m170 -86.02 71.16 10.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 -179.88 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.75 HD11 ' HB3' ' A' ' 67' ' ' LEU . 3.8 mp -59.08 -27.14 35.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.07 179.818 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.415 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 3.3 mttp -148.73 164.77 20.02 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.637 -179.804 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.415 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 42.0 Cg_endo -67.4 -3.22 9.65 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.447 2.098 . . . . 0.0 112.848 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -139.19 26.71 2.39 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.675 179.708 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.828 HG11 HG21 ' A' ' 30' ' ' VAL . 52.1 t -143.42 146.16 21.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.264 -179.909 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.807 HD12 HD12 ' A' ' 87' ' ' LEU . 1.7 mt -147.95 96.58 2.67 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.718 179.855 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.765 HD22 ' N ' ' A' ' 68' ' ' VAL . 1.4 tm? -84.51 134.87 34.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.01 -179.986 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.765 ' N ' HD22 ' A' ' 67' ' ' LEU . 94.7 t -106.83 119.83 57.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.399 179.261 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.735 ' CD2' HD11 ' A' ' 76' ' ' LEU . 13.6 p90 -136.13 178.32 7.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.062 -179.498 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.763 ' HB2' HD11 ' A' ' 77' ' ' ILE . 5.2 tp -130.29 168.5 16.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.914 179.977 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -120.47 110.01 27.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.117 -179.981 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.87 176.48 5.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.778 179.986 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -59.78 103.16 0.19 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.905 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 55.89 24.52 7.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.119 -179.855 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -149.61 153.56 37.26 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.91 -179.957 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.735 HD11 ' CD2' ' A' ' 69' ' ' TYR . 8.0 tt -123.88 144.14 49.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.684 179.853 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.768 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.5 pp -129.33 138.05 55.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.315 -179.788 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.741 HD11 HD11 ' A' ' 4' ' ' LEU . 89.6 mt -86.58 131.46 34.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.553 179.625 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.611 HD21 ' CE1' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -91.78 -74.17 0.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.104 -179.607 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.619 ' NH1' HD21 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -155.75 177.68 11.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.874 0.369 . . . . 0.0 111.345 -179.845 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.766 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.5 tm? -119.2 134.76 55.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.93 -179.885 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.766 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -140.61 -173.18 13.3 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.538 179.961 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.9 m -144.58 171.07 14.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.867 0.365 . . . . 0.0 110.99 -179.968 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -59.68 -28.45 67.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.95 179.91 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.2 m -87.83 -26.31 22.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.087 -179.985 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -80.67 -70.21 0.54 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.912 -179.932 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.807 HD12 HD12 ' A' ' 66' ' ' LEU . 1.0 OUTLIER -70.25 -38.29 75.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.01 -179.908 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.919 179.984 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.813 0.34 . . . . 0.0 111.217 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.5 mt 60.8 160.86 0.05 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.015 179.832 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.12 150.72 28.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.851 179.927 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.547 HD11 HD11 ' A' ' 78' ' ' LEU . 1.7 tt -116.06 147.5 41.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.916 179.996 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.819 ' HB2' HG22 ' A' ' 77' ' ' ILE . 2.3 t30 -133.9 -178.39 5.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.943 179.945 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.3 mt -142.82 112.14 6.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.874 -179.93 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.2 mmtp -85.61 161.63 19.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.88 -179.997 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 17.4 mmtm -62.06 -30.85 71.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.951 179.969 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.0 t -72.15 -33.27 67.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.98 179.929 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.739 ' HE1' HD13 ' A' ' 67' ' ' LEU . 43.6 t80 -73.97 -31.1 62.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.904 -179.936 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -65.39 -40.72 93.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.929 179.977 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 17.5 mttt -88.63 -11.17 46.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.317 179.962 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.407 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 1.2 m-20 -90.44 -26.21 19.96 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.828 0.347 . . . . 0.0 110.415 179.516 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.791 ' O ' HD13 ' A' ' 18' ' ' LEU . 66.4 t80 -91.09 -70.71 0.67 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.177 179.866 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.702 ' HA ' HD22 ' A' ' 18' ' ' LEU . 4.2 t0 -62.6 -52.47 63.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.833 -179.197 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -62.41 -17.68 59.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.62 -179.279 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.407 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 44.9 tp -90.23 -40.94 11.87 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.075 0.464 . . . . 0.0 110.34 179.566 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.791 HD13 ' O ' ' A' ' 14' ' ' PHE . 0.0 OUTLIER -48.86 -45.26 40.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.192 -179.705 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.1 mt -90.06 0.79 56.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.802 -179.482 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -97.92 30.79 2.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.853 0.359 . . . . 0.0 111.003 -179.984 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 92.38 22.86 28.19 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.685 179.929 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.585 ' CD1' HD12 ' A' ' 18' ' ' LEU . 30.2 t80 -110.08 127.06 54.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.843 0.354 . . . . 0.0 110.704 179.845 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.575 ' HB3' HG23 ' A' ' 26' ' ' VAL . 4.9 t0 -68.09 110.35 3.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.888 -179.979 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.547 ' HA ' HD23 ' A' ' 27' ' ' LEU . 11.4 p-10 -61.71 -19.46 62.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.222 179.836 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.66 -20.91 66.09 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.273 179.987 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.575 HG23 ' HB3' ' A' ' 23' ' ' ASP . 21.8 t -82.1 -40.2 17.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.426 -179.752 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.609 HD13 ' CZ ' ' A' ' 14' ' ' PHE . 1.2 pp -56.6 -36.56 69.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.965 -179.777 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.732 ' O ' HD22 ' A' ' 32' ' ' LEU . 11.6 t30 -63.23 -16.2 59.47 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.408 -179.97 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.418 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 57.2 mt-10 -90.12 -35.27 15.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.837 0.351 . . . . 0.0 111.218 -179.716 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 1.051 HG23 HG21 ' A' ' 61' ' ' ILE . 11.8 p -90.5 -32.2 5.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.367 -0.379 . . . . 0.0 112.002 -179.589 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.926 HD12 HG13 ' A' ' 30' ' ' VAL . 1.7 mp -76.49 -48.86 25.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.578 -179.446 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.732 HD22 ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -56.96 -22.43 37.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.683 0.278 . . . . 0.0 111.189 -179.752 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.724 ' N ' HD23 ' A' ' 32' ' ' LEU . 93.5 m -82.68 -28.93 30.29 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.878 0.371 . . . . 0.0 110.808 179.66 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.725 HD21 HD21 ' A' ' 40' ' ' LEU . 12.6 mt -90.12 -23.04 21.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.731 -179.421 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -104.16 20.24 18.67 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -179.176 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.466 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 7.4 mtmt -118.37 -55.85 2.19 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.211 179.79 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.466 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 10.1 pttm 156.29 -20.54 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.035 179.665 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -61.86 111.27 4.2 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.072 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -68.64 163.86 35.35 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.412 2.075 . . . . 0.0 112.117 179.8 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.725 HD21 HD21 ' A' ' 34' ' ' LEU . 5.2 mt -86.44 123.42 31.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.064 179.977 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -61.6 157.26 48.74 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.947 -179.871 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.77 -30.56 49.89 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.616 2.21 . . . . 0.0 112.294 179.875 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.79 -19.47 59.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.01 179.822 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.439 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.1 m-85 -62.69 -16.52 57.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.217 179.983 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 67.44 52.06 0.82 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.923 0.392 . . . . 0.0 110.952 -179.862 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.6 p-10 -88.28 107.69 18.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.787 179.902 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.96 -168.29 3.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.855 -179.965 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -90.8 126.89 36.15 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.143 179.855 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.489 HD21 ' CD ' ' A' ' 58' ' ' GLU . 1.5 mp -64.48 169.01 5.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.895 179.93 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.42 167.75 10.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.09 179.948 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.27 -126.3 7.32 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.559 -179.94 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.03 -5.22 55.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.639 0.257 . . . . 0.0 111.37 179.965 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 6.0 m0 -97.65 29.31 3.39 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.89 0.376 . . . . 0.0 110.966 179.949 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.527 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -66.83 -56.2 14.9 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.407 -179.871 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 19.0 Cg_endo -59.2 -12.65 16.74 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.343 2.029 . . . . 0.0 112.572 -179.994 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.457 ' CD1' HD21 ' A' ' 79' ' ' LEU . 17.7 m-85 -93.71 170.12 9.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.841 0.353 . . . . 0.0 110.865 179.949 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.78 132.95 44.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.793 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.516 ' HG3' HG22 ' A' ' 68' ' ' VAL . 1.8 tt0 -104.76 170.01 8.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.971 -179.961 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.41 ' SG ' HD13 ' A' ' 40' ' ' LEU . 16.3 t -164.94 122.45 1.6 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.764 -179.981 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 10.4 m170 -93.02 84.22 4.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.068 -179.826 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 1.051 HG21 HG23 ' A' ' 30' ' ' VAL . 3.6 mp -64.82 -49.58 79.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.041 0.448 . . . . 0.0 110.811 179.714 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.617 ' HD2' HG22 ' A' ' 61' ' ' ILE . 0.1 OUTLIER -111.03 174.11 2.52 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.476 -179.851 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.412 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 12.9 Cg_exo -69.1 -5.82 16.74 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.617 2.211 . . . . 0.0 112.78 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -150.19 34.18 0.65 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.782 179.941 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.861 ' O ' HD23 ' A' ' 66' ' ' LEU . 88.5 t -133.7 142.68 40.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.94 -179.835 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.861 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.6 OUTLIER -145.97 98.81 3.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.876 179.97 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.739 HD13 ' HE1' ' A' ' 10' ' ' PHE . 1.0 OUTLIER -97.65 113.39 25.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.552 179.983 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.529 ' N ' HD12 ' A' ' 67' ' ' LEU . 60.9 t -85.24 138.07 19.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.255 -179.835 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 31.4 p90 -143.8 147.14 33.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.863 179.781 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.803 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.3 OUTLIER -103.28 157.36 17.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.871 -179.892 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.682 ' H ' HD23 ' A' ' 70' ' ' LEU . 21.6 t -107.81 109.92 30.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.25 -179.929 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.66 165.97 19.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.623 179.8 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -41.88 -32.73 0.44 Allowed 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.378 -179.811 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -163.43 29.9 0.09 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.805 179.757 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -150.0 162.02 41.19 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.7 -179.864 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.2 tp -117.13 137.23 52.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.93 0.395 . . . . 0.0 110.66 179.706 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.819 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.4 pp -128.16 137.75 56.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.245 -179.849 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.547 HD11 HD11 ' A' ' 4' ' ' LEU . 80.0 mt -84.24 119.93 25.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.738 179.788 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.497 HD13 HG12 ' A' ' 68' ' ' VAL . 0.2 OUTLIER -78.32 -68.86 0.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.901 -179.925 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.466 ' HD3' ' HB3' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -163.04 170.26 18.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.917 0.389 . . . . 0.0 111.355 179.826 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.755 HD21 HG13 ' A' ' 65' ' ' VAL . 3.4 tm? -126.91 134.19 50.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.662 179.96 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.565 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -160.39 -168.83 22.87 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.554 179.985 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.1 m -123.85 178.12 5.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.914 0.388 . . . . 0.0 110.732 -179.93 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -60.7 -29.3 69.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.001 -179.857 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.1 t -85.62 -30.43 23.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.035 -179.882 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.53 -71.68 0.4 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.898 -179.827 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.44 HD13 ' HB2' ' A' ' 66' ' ' LEU . 1.0 OUTLIER -63.4 -33.36 75.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.867 179.999 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.811 -179.96 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 120.734 0.302 . . . . 0.0 111.166 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.2 mt -137.45 163.75 30.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.904 179.978 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.83 165.61 3.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.818 179.969 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.6 tt -133.95 153.8 51.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.996 -179.919 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.765 ' HB2' HG22 ' A' ' 77' ' ' ILE . 7.0 t30 -138.19 -178.11 5.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.806 -179.993 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.612 HD23 HD12 ' A' ' 78' ' ' LEU . 15.4 mt -146.14 133.37 20.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.976 -179.956 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.82 164.34 11.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.796 179.968 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.4 -31.73 72.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.93 -179.96 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.6 p -70.29 -37.31 74.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.92 179.988 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -59.2 -49.74 76.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.894 -179.948 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -64.03 -44.36 92.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.916 -179.995 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.0 mmtt -74.37 -7.67 53.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.526 179.968 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.28 -31.76 16.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.767 0.317 . . . . 0.0 110.962 -179.913 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.753 ' HE2' HD13 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -90.21 -54.9 3.82 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.344 179.944 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -49.46 -32.37 11.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.769 179.474 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.57 -22.35 26.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.86 179.62 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.417 ' O ' ' HB3' ' A' ' 22' ' ' PHE . 2.6 mt -83.77 -49.54 8.99 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 120.943 0.401 . . . . 0.0 110.264 179.682 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.803 HD13 ' HD1' ' A' ' 22' ' ' PHE . 4.3 mm? -47.26 -40.51 16.74 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.398 179.957 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.5 mt -89.54 -0.49 57.54 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.899 -179.405 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -98.52 33.49 2.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.804 0.335 . . . . 0.0 110.782 -179.887 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.66 23.53 53.04 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.331 -179.924 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.803 ' HD1' HD13 ' A' ' 18' ' ' LEU . 26.4 t80 -107.1 115.84 30.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.809 0.338 . . . . 0.0 110.675 -179.868 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.413 ' O ' ' CD1' ' A' ' 22' ' ' PHE . 5.9 t70 -55.1 146.25 18.85 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.193 -179.742 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.522 ' HA ' HD23 ' A' ' 27' ' ' LEU . 3.3 p30 -96.52 -29.22 14.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.048 -179.988 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.1 m -57.62 -40.61 79.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.112 -179.861 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.404 HG12 ' HB3' ' A' ' 23' ' ' ASP . 12.2 p -74.62 -26.85 20.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.332 -179.999 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.753 HD13 ' HE2' ' A' ' 14' ' ' PHE . 0.3 OUTLIER -59.71 -39.98 86.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.829 0.347 . . . . 0.0 110.901 -179.957 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.472 ' O ' ' HB3' ' A' ' 32' ' ' LEU . 32.1 t-20 -50.27 -57.62 7.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.025 -179.759 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.566 ' HA ' HD22 ' A' ' 32' ' ' LEU . 28.8 mt-10 -51.77 -19.83 1.85 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.744 179.952 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.457 HG22 ' HG3' ' A' ' 62' ' ' LYS . 76.6 t -88.94 -74.36 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.836 0.351 . . . . 0.0 111.746 -179.452 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.7 mp -50.77 -45.39 27.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.15 -0.477 . . . . 0.0 112.011 -178.982 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.891 HD23 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -57.05 -34.61 68.41 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 121.001 -0.28 . . . . 0.0 111.061 -179.498 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.891 ' N ' HD23 ' A' ' 32' ' ' LEU . 90.2 m -68.68 -27.11 65.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.796 0.331 . . . . 0.0 110.875 179.88 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 46.7 mt -90.06 -25.73 20.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.414 -179.719 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 20.4 mtp180 -104.17 20.12 18.9 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.278 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.507 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -115.62 -55.85 2.4 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.168 179.886 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.507 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 151.15 -20.43 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.996 0.518 . . . . 0.0 110.882 179.74 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.39 120.6 41.44 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.085 -179.638 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -72.49 -179.34 4.0 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.342 2.028 . . . . 0.0 112.135 179.882 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -123.2 129.28 51.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.84 179.958 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.414 ' HB2' ' CE1' ' A' ' 44' ' ' PHE . 1.9 m-20 -57.41 159.26 9.12 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.115 -179.887 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.75 -10.06 27.0 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.552 2.168 . . . . 0.0 112.471 -179.98 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.33 9.47 23.17 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.339 179.857 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.414 ' CE1' ' HB2' ' A' ' 41' ' ' ASP . 4.1 m-85 -89.43 8.42 30.94 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.292 179.864 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.426 ' HB2' ' CD2' ' A' ' 60' ' ' HIS . 1.2 mp0 60.31 40.0 18.2 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.824 0.345 . . . . 0.0 110.9 179.882 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -82.06 73.08 9.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.844 179.963 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -129.49 172.35 11.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.857 179.947 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -81.62 133.7 35.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.071 -179.946 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.627 HD11 ' HG3' ' A' ' 58' ' ' GLU . 15.4 mt -82.37 176.14 9.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.857 -179.993 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.7 mtpt -114.29 175.66 5.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.924 179.968 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.38 -128.78 13.71 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.5 -179.929 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.1 mmtt -67.98 -26.39 65.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.591 0.234 . . . . 0.0 110.889 179.995 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 5.6 m-90 -97.59 39.38 1.21 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.832 0.349 . . . . 0.0 110.887 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.461 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -75.35 -51.04 3.45 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.205 179.971 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 71.9 Cg_endo -77.73 3.52 6.84 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.32 2.013 . . . . 0.0 112.671 -179.988 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.418 ' HB3' ' CG1' ' A' ' 68' ' ' VAL . 12.4 m-85 -114.21 169.31 9.12 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.796 0.331 . . . . 0.0 110.89 179.904 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.41 ' HG2' ' CZ ' ' A' ' 69' ' ' TYR . 1.0 OUTLIER -128.58 145.22 51.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.947 -179.987 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.627 ' HG3' HD11 ' A' ' 49' ' ' LEU . 1.4 tt0 -102.75 165.78 10.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.909 179.946 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -162.31 116.72 1.83 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.855 179.938 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.426 ' CD2' ' HB2' ' A' ' 45' ' ' GLN . 5.0 m170 -90.68 85.88 6.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.986 179.978 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.587 ' H ' HD12 ' A' ' 61' ' ' ILE . 4.3 mp -59.8 -29.17 42.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.021 -179.978 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.457 ' HG3' HG22 ' A' ' 30' ' ' VAL . 4.7 mtpt -142.61 168.34 13.61 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.77 -179.911 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.403 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 20.3 Cg_exo -65.43 -6.71 14.09 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.643 2.229 . . . . 0.0 112.743 -179.916 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -138.64 25.95 2.57 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.86 179.789 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.402 ' O ' HD23 ' A' ' 66' ' ' LEU . 67.5 t -140.78 140.83 32.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.218 179.945 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 1.082 HD12 HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -157.31 114.86 3.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.485 179.974 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.662 HD12 ' O ' ' A' ' 68' ' ' VAL . 0.2 OUTLIER -121.23 139.43 53.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.039 -179.881 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.662 ' O ' HD12 ' A' ' 67' ' ' LEU . 39.2 t -88.69 147.0 5.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.794 179.841 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.41 ' CZ ' ' HG2' ' A' ' 57' ' ' ARG . 9.0 p90 -148.99 161.08 42.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.115 -179.974 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.802 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.3 OUTLIER -116.06 156.69 25.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.828 179.958 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.659 ' H ' HD23 ' A' ' 70' ' ' LEU . 21.3 t -107.33 99.75 9.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.184 179.951 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.76 170.72 13.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.781 179.947 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -60.43 104.25 0.31 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.809 179.945 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 57.17 20.98 6.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.139 -179.843 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -149.55 138.51 21.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.639 -179.982 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.37 148.33 24.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.867 179.699 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.802 HD11 ' HB2' ' A' ' 70' ' ' LEU . 1.9 pp -139.32 130.8 34.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.331 -179.87 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.612 HD12 HD23 ' A' ' 6' ' ' LEU . 80.0 mt -74.96 148.21 40.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.511 179.677 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.38 -73.58 0.68 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.273 -179.698 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.02 161.52 42.18 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.989 0.423 . . . . 0.0 111.499 -179.8 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.581 ' C ' HD13 ' A' ' 81' ' ' LEU . 3.4 tm? -115.01 131.56 56.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.694 179.881 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.581 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -137.17 -177.75 15.32 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.451 179.931 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.7 m -150.72 178.14 9.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.879 0.371 . . . . 0.0 110.893 179.995 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.0 t-80 -64.04 -27.17 68.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.948 -179.998 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.7 m -87.41 -28.26 22.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.945 179.94 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -85.62 -74.82 0.39 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.015 -179.895 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 1.082 HD12 HD12 ' A' ' 66' ' ' LEU . 41.3 mt -62.08 -41.74 98.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.956 -179.909 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.887 179.982 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.7 tpt . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.699 0.285 . . . . 0.0 111.468 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 40.1 mt -110.21 -178.67 3.57 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.845 0.355 . . . . 0.0 110.885 -179.952 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.34 149.17 22.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.884 179.915 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.408 HD11 HD11 ' A' ' 78' ' ' LEU . 0.6 OUTLIER -115.66 148.15 40.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.956 179.912 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.78 ' HB2' HG22 ' A' ' 77' ' ' ILE . 5.6 t30 -133.46 176.75 8.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.824 179.948 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 54.1 mt -148.98 112.8 5.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.928 179.933 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.3 mmtt -86.89 176.87 7.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.935 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.06 -33.57 68.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.845 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.4 t -67.23 -35.9 80.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.949 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.644 ' HE2' HD13 ' A' ' 67' ' ' LEU . 22.2 t80 -72.06 -31.15 65.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.877 179.933 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -68.99 -40.45 78.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.843 179.976 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.402 ' O ' ' CB ' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -85.73 -9.49 57.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.336 -179.999 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.65 ' O ' HD12 ' A' ' 17' ' ' LEU . 0.7 OUTLIER -90.36 -27.18 19.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.714 0.292 . . . . 0.0 111.008 179.915 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.512 ' CE1' HD21 ' A' ' 18' ' ' LEU . 7.4 t80 -91.23 -69.52 0.73 Allowed 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.334 179.704 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.528 ' HA ' HD12 ' A' ' 18' ' ' LEU . 21.1 t0 -49.19 -50.08 39.69 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.239 179.719 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.402 ' CB ' ' O ' ' A' ' 12' ' ' LYS . 1.5 tpmp? -68.08 -13.52 62.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.205 -179.982 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.65 HD12 ' O ' ' A' ' 13' ' ' ASP . 3.9 mt -90.27 -55.09 3.74 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-O 121.189 0.518 . . . . 0.0 110.013 179.503 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.528 HD12 ' HA ' ' A' ' 15' ' ' ASP . 0.5 OUTLIER -54.57 -25.89 28.99 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.379 179.868 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 74.9 mt -90.08 -35.15 15.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.941 179.954 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -62.56 -23.36 66.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.146 -179.968 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.99 42.62 0.16 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.47 -179.946 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -113.44 123.54 50.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.777 0.323 . . . . 0.0 110.724 179.908 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.649 ' HB3' HG23 ' A' ' 26' ' ' VAL . 2.7 t0 -56.38 103.27 0.1 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.897 179.944 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.462 ' CA ' HD23 ' A' ' 27' ' ' LEU . 5.1 p30 -54.93 -28.71 53.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.026 -179.962 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.13 -27.05 52.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.095 -179.959 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.649 HG23 ' HB3' ' A' ' 23' ' ' ASP . 35.2 t -72.51 -35.74 52.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.261 -179.88 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.497 ' HB2' HD13 ' A' ' 31' ' ' ILE . 1.2 pp -58.54 -36.66 74.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.186 -179.625 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.848 ' O ' HD22 ' A' ' 32' ' ' LEU . 0.9 OUTLIER -58.42 -19.63 37.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.319 -179.798 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -90.06 -37.69 14.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.388 -179.624 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.833 HG13 HD12 ' A' ' 31' ' ' ILE . 14.8 p -90.31 -44.99 14.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 112.162 0.431 . . . . 0.0 112.162 -179.197 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.833 HD12 HG13 ' A' ' 30' ' ' VAL . 1.7 mp -62.25 -51.94 66.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.55 0.214 . . . . 0.0 111.408 -179.506 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.848 HD22 ' O ' ' A' ' 28' ' ' ASN . 0.4 OUTLIER -53.9 -37.24 63.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.716 0.293 . . . . 0.0 111.081 -179.576 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.722 ' H ' HD23 ' A' ' 32' ' ' LEU . 84.8 m -65.88 -37.65 86.71 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.866 0.365 . . . . 0.0 110.598 179.867 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.406 HD11 ' CD2' ' A' ' 67' ' ' LEU . 97.2 mt -72.82 -30.01 63.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.841 179.924 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.4 mtp180 -102.95 20.13 18.11 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.997 -179.983 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.441 ' O ' ' CG ' ' A' ' 37' ' ' LYS . 2.5 mmmt -116.85 19.38 14.43 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.369 -179.899 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.441 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 3.9 pttp 45.77 39.2 4.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.263 -179.957 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -108.07 111.91 61.78 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.731 -179.922 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -67.3 136.87 41.67 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.419 2.079 . . . . 0.0 112.257 179.961 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.479 HD13 ' SG ' ' A' ' 59' ' ' CYS . 27.0 mt -79.45 179.8 7.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.877 179.984 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -112.23 155.71 43.12 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.932 -179.988 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -67.17 -10.93 30.32 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 122.629 2.219 . . . . 0.0 112.537 179.92 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.96 7.23 25.14 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.417 179.937 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -93.47 14.95 17.08 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.585 0.231 . . . . 0.0 111.121 179.89 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 59.25 38.17 23.43 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.868 0.366 . . . . 0.0 110.972 179.89 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -93.55 112.72 24.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.927 179.945 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 24.8 p-80 -163.36 -175.74 4.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.899 -179.981 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.38 129.58 35.0 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.113 179.97 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.424 ' H ' HD12 ' A' ' 49' ' ' LEU . 4.4 mp -74.39 174.63 8.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.829 -179.929 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -102.63 163.58 12.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.895 -179.915 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.25 -137.51 18.51 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.602 -179.92 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.56 -5.07 48.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.649 0.261 . . . . 0.0 111.45 179.965 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 9.5 m0 -97.05 33.2 1.97 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.791 0.329 . . . . 0.0 111.096 -179.955 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.438 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 7.2 tttt -81.44 -51.05 0.89 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.962 179.957 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.448 ' O ' HD11 ' A' ' 70' ' ' LEU . 50.2 Cg_exo -55.46 -18.12 18.59 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.425 2.084 . . . . 0.0 112.367 179.749 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -102.1 177.86 4.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.904 0.383 . . . . 0.0 111.012 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.545 ' O ' HG13 ' A' ' 68' ' ' VAL . 5.7 tpp180 -135.96 139.63 43.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.936 179.984 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.404 ' HB2' HD11 ' A' ' 49' ' ' LEU . 4.6 tt0 -95.95 158.68 15.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.815 179.955 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.479 ' SG ' HD13 ' A' ' 40' ' ' LEU . 2.6 t -160.94 113.41 1.93 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.866 -179.945 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.423 ' ND1' HD22 ' A' ' 66' ' ' LEU . 3.5 m-70 -97.2 89.46 4.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.981 179.928 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.648 HD11 HD23 ' A' ' 67' ' ' LEU . 4.4 mp -55.08 -27.49 19.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.013 179.762 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.441 ' HB2' ' CD ' ' A' ' 63' ' ' PRO . 0.0 OUTLIER -154.77 170.96 7.76 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.551 179.971 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.441 ' CD ' ' HB2' ' A' ' 62' ' ' LYS . 17.0 Cg_exo -67.0 -0.06 4.33 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.689 2.259 . . . . 0.0 113.164 -179.702 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -134.86 25.21 3.64 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.664 0.268 . . . . 0.0 111.157 179.89 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.616 HG13 HD21 ' A' ' 81' ' ' LEU . 58.4 t -155.63 143.63 12.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.004 0.431 . . . . 0.0 111.309 179.913 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.825 HD12 HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -159.13 100.43 1.54 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.693 179.794 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.648 HD23 HD11 ' A' ' 61' ' ' ILE . 0.3 OUTLIER -105.84 151.51 24.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.893 -179.858 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.545 HG13 ' O ' ' A' ' 57' ' ' ARG . 59.0 t -100.53 139.95 20.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.13 -179.914 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.672 ' CD1' HD11 ' A' ' 76' ' ' LEU . 16.9 p90 -145.66 158.48 43.84 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.924 179.912 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.623 ' HB2' HD11 ' A' ' 77' ' ' ILE . 6.7 tp -114.08 157.77 22.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.857 179.866 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -113.75 105.34 18.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.206 -179.919 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 10.6 tptt -76.09 165.73 24.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.666 179.815 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -44.53 -31.87 1.24 Allowed 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.363 -179.942 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -160.4 28.79 0.16 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.787 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -148.55 163.51 36.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.654 179.985 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.672 HD11 ' CD1' ' A' ' 69' ' ' TYR . 10.0 tp -122.52 130.9 53.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.673 179.658 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.78 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.1 pp -122.8 133.35 69.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.349 -179.665 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.408 HD11 HD11 ' A' ' 4' ' ' LEU . 85.7 mt -82.25 126.61 32.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.637 179.648 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.38 -66.21 0.92 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.055 -179.783 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.52 ' HE ' HG21 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -162.13 165.71 26.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.989 0.423 . . . . 0.0 111.478 -179.945 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.702 HD22 ' N ' ' A' ' 82' ' ' GLY . 1.7 tm? -124.7 135.65 53.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.656 -179.913 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.702 ' N ' HD22 ' A' ' 81' ' ' LEU . . . -162.3 -172.19 29.42 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.687 179.932 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.92 -167.97 1.96 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.837 0.351 . . . . 0.0 110.878 -179.915 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -73.54 -27.53 61.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.022 -179.964 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.5 t -86.56 -22.69 26.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.221 -180.0 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -87.28 -69.13 0.7 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.853 0.359 . . . . 0.0 111.041 -179.987 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.825 HD12 HD12 ' A' ' 66' ' ' LEU . 25.4 mt -59.83 -40.68 89.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.025 -179.959 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.892 179.971 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.859 0.361 . . . . 0.0 111.107 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 62.1 mt -107.23 158.33 17.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.911 179.994 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.69 156.11 17.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.918 179.997 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.442 HD11 HD11 ' A' ' 78' ' ' LEU . 2.2 tt -120.28 143.75 48.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.842 179.939 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.457 ' HB2' HG22 ' A' ' 77' ' ' ILE . 1.5 t-20 -126.7 178.5 5.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.985 -179.929 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 41.0 mt -144.18 123.12 12.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.899 179.965 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.3 mmmt -97.05 174.42 6.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.978 -179.924 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.06 -46.53 80.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.802 179.911 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 t -58.06 -24.11 57.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.934 179.831 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.742 ' HE1' HD13 ' A' ' 67' ' ' LEU . 32.9 t80 -84.23 -26.59 28.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.034 179.976 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -69.51 -28.03 65.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.204 -179.782 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.477 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -90.04 -7.47 53.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.781 -179.745 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.502 ' OD2' ' HA ' ' A' ' 10' ' ' PHE . 18.4 p30 -90.6 -15.97 29.57 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.894 0.378 . . . . 0.0 111.57 -179.811 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.649 ' O ' HD13 ' A' ' 18' ' ' LEU . 8.8 t80 -90.86 -60.21 1.97 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.228 -178.994 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.789 ' HA ' HD22 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -91.6 -41.0 11.01 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.374 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.477 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 2.0 mptm? -69.99 -40.08 75.53 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -178.839 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.407 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 0.9 OUTLIER -59.39 -29.39 67.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.929 0.395 . . . . 0.0 110.214 179.698 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.789 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.3 OUTLIER -62.47 -24.1 67.27 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.116 179.856 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.2 15.11 10.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.393 -179.885 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -123.87 45.0 2.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.818 0.342 . . . . 0.0 110.885 179.873 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 71.21 28.89 69.32 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.328 -179.946 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.468 ' CD1' HD12 ' A' ' 18' ' ' LEU . 8.9 t80 -113.18 140.58 47.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.854 0.359 . . . . 0.0 110.783 -179.93 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.419 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 4.3 t0 -97.49 117.9 32.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.902 179.987 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.821 ' HA ' HD23 ' A' ' 27' ' ' LEU . 2.9 p30 -59.73 -28.73 67.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.237 -179.923 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 25.1 p -54.96 -23.31 18.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.542 -179.83 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.6 t -87.38 -42.71 15.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.765 0.317 . . . . 0.0 111.384 -179.726 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.821 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.4 OUTLIER -59.25 -32.27 69.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.01 -179.833 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -53.51 -31.2 45.07 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.875 -179.986 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -81.63 -23.35 37.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.824 179.696 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 96.2 t -78.08 -73.1 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.023 -179.973 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.6 mp -47.45 -33.57 3.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.865 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.844 HD23 ' N ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -58.86 -55.18 38.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.565 179.72 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.844 ' N ' HD23 ' A' ' 32' ' ' LEU . 99.2 m -58.53 -34.76 71.35 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.945 -179.943 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.0 mt -66.75 -46.79 74.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.841 -179.978 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -96.04 20.15 10.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.084 179.994 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.8 mmtt -97.37 12.67 32.33 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.398 -179.905 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.4 mtmt 61.94 27.42 16.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.778 0.323 . . . . 0.0 110.832 179.964 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.25 123.72 29.17 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.863 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -74.31 150.22 41.44 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.361 2.04 . . . . 0.0 112.379 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.416 HD13 ' SG ' ' A' ' 59' ' ' CYS . 4.8 mt -88.27 128.05 35.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.818 179.996 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.26 158.22 88.07 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.066 -179.953 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.66 -10.33 28.36 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.526 2.15 . . . . 0.0 112.455 179.857 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.1 5.86 27.97 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.316 179.817 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -93.69 17.28 12.12 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-O 120.662 0.267 . . . . 0.0 111.183 179.872 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.421 ' HB2' ' CG ' ' A' ' 60' ' ' HIS . 45.0 mm-40 63.98 30.29 14.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.087 179.882 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -88.68 87.92 7.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.906 -179.962 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 17.8 p-80 -143.45 176.37 9.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.873 179.992 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.26 140.29 46.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.101 -179.959 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.572 HD21 ' OE1' ' A' ' 58' ' ' GLU . 1.4 mt -89.7 174.17 7.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.946 179.884 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.0 mtpm? -109.34 164.6 12.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.946 179.981 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.76 -140.91 22.18 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.513 179.989 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.2 tmtt? -74.02 -8.53 56.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.598 0.237 . . . . 0.0 111.352 -179.974 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 19.7 m-90 -96.51 26.39 4.45 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.762 0.315 . . . . 0.0 111.197 -179.942 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.461 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.2 OUTLIER -74.54 -49.52 4.92 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.002 179.911 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.461 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 43.6 Cg_exo -56.45 -17.65 22.37 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.4 2.067 . . . . 0.0 112.437 179.779 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -110.27 174.45 5.86 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.004 -179.87 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.458 ' O ' HG13 ' A' ' 68' ' ' VAL . 41.5 ttm180 -131.13 154.52 48.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.813 179.923 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.572 ' OE1' HD21 ' A' ' 49' ' ' LEU . 3.4 tt0 -105.03 170.14 8.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.931 -179.928 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.416 ' SG ' HD13 ' A' ' 40' ' ' LEU . 3.5 t -168.5 116.88 0.7 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.738 179.997 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.609 ' CD2' HD22 ' A' ' 66' ' ' LEU . 11.1 m170 -95.32 89.08 5.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.993 -179.938 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.582 ' H ' HD12 ' A' ' 61' ' ' ILE . 4.2 mp -66.25 -29.88 48.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.903 179.778 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 16.8 mttt -136.68 171.79 8.08 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.78 179.966 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -68.18 -3.12 10.14 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.663 2.242 . . . . 0.0 112.906 -179.984 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -147.23 30.39 0.94 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.785 179.82 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.814 ' O ' HD23 ' A' ' 66' ' ' LEU . 58.8 t -138.37 144.13 31.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.277 179.88 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.814 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.6 OUTLIER -149.8 108.44 3.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.771 -179.975 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.742 HD13 ' HE1' ' A' ' 10' ' ' PHE . 0.1 OUTLIER -108.69 133.54 52.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.001 0.429 . . . . 0.0 110.989 -179.957 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.49 ' N ' HD12 ' A' ' 67' ' ' LEU . 97.4 t -94.7 140.96 15.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.724 179.751 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.479 ' CD2' HD21 ' A' ' 76' ' ' LEU . 3.1 p90 -146.06 168.48 20.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.905 179.945 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.769 ' HB2' HD11 ' A' ' 77' ' ' ILE . 0.3 OUTLIER -125.64 -178.01 4.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.95 -179.822 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.7 t -128.27 115.81 39.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.075 179.871 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -99.51 -178.42 3.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.862 179.99 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -66.28 103.54 1.03 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.854 -179.898 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 56.82 22.73 7.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.14 179.984 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -155.28 136.34 13.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.819 -179.975 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.479 HD21 ' CD2' ' A' ' 69' ' ' TYR . 4.5 tp -93.93 154.4 17.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.878 -179.992 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.769 HD11 ' HB2' ' A' ' 70' ' ' LEU . 1.9 pp -138.27 132.92 42.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.266 -179.94 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.54 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 55.4 mt -81.33 142.06 33.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.566 179.686 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.413 HD12 ' HD3' ' A' ' 80' ' ' ARG . 0.2 OUTLIER -99.71 -71.12 0.71 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.279 -179.63 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.413 ' HD3' HD12 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -157.36 161.08 39.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.011 0.434 . . . . 0.0 111.498 -179.587 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.541 ' C ' HD13 ' A' ' 81' ' ' LEU . 3.2 tm? -112.51 125.33 54.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.566 179.94 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.522 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -136.27 -161.91 9.31 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.66 -179.918 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.4 p -150.57 -177.75 6.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.904 0.383 . . . . 0.0 110.846 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -66.77 -27.98 68.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.995 179.991 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -87.36 -24.97 24.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.193 -179.96 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.15 -73.63 0.43 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.897 -179.888 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.63 HD12 ' HB2' ' A' ' 66' ' ' LEU . 23.3 mt -61.32 -41.08 96.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.93 -179.96 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.213 -0.898 . . . . 0.0 110.868 -179.952 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 120.717 0.294 . . . . 0.0 111.485 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 mt -83.11 -175.79 6.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.915 0.388 . . . . 0.0 110.84 179.995 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.79 155.91 12.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.836 179.98 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.79 147.46 46.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.993 -179.936 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.744 ' HB2' HG22 ' A' ' 77' ' ' ILE . 1.2 t-20 -133.33 177.62 7.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.849 179.91 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.8 mp -143.48 132.55 22.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.969 179.968 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.429 ' HE2' HD13 ' A' ' 77' ' ' ILE . 30.1 mmtm -107.39 158.91 16.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.806 180.0 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.3 mttp -61.77 -32.67 72.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.765 179.955 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 88.8 p -63.57 -23.31 67.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.153 179.925 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.59 ' HE1' HD13 ' A' ' 67' ' ' LEU . 53.8 t80 -78.14 -32.07 50.16 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.085 -179.811 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -70.06 -47.88 60.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.128 -179.905 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -75.21 -6.49 49.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.556 -179.959 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.538 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -90.83 -22.6 20.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.976 179.937 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.666 ' CZ ' HD22 ' A' ' 27' ' ' LEU . 43.6 t80 -90.81 -70.85 0.66 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.552 -179.74 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -49.72 -35.81 23.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.212 -179.871 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.481 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 4.5 tppt? -76.57 -20.89 56.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.981 179.88 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.664 HD11 ' OE1' ' A' ' 86' ' ' GLU . 1.6 mt -89.61 -52.21 5.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.951 0.405 . . . . 0.0 110.151 179.187 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.631 HD13 ' HD2' ' A' ' 22' ' ' PHE . 4.3 mm? -49.2 -32.43 10.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.536 -179.771 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.55 ' C ' HD12 ' A' ' 19' ' ' LEU . 4.4 pp -89.65 -8.22 52.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.708 -179.629 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -96.6 40.11 1.14 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.846 0.355 . . . . 0.0 110.846 -179.954 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 70.01 27.6 72.82 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.495 -179.936 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.631 ' HD2' HD13 ' A' ' 18' ' ' LEU . 67.6 t80 -95.35 128.14 41.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.827 0.346 . . . . 0.0 110.81 -179.95 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.405 ' HB3' HG23 ' A' ' 26' ' ' VAL . 0.7 OUTLIER -56.98 119.6 6.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.915 -179.97 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.542 ' HA ' HD23 ' A' ' 27' ' ' LEU . 9.0 p-10 -82.59 -34.84 27.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.157 -179.796 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.68 -22.62 47.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.257 -179.929 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.405 HG23 ' HB3' ' A' ' 23' ' ' ASP . 21.3 t -82.48 -35.06 12.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.392 -179.871 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.666 HD22 ' CZ ' ' A' ' 14' ' ' PHE . 0.8 OUTLIER -56.98 -36.45 70.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.107 -179.69 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.404 ' N ' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -62.77 -23.36 67.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.269 -179.798 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -80.04 -33.82 38.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.138 -179.814 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.723 HG13 HD12 ' A' ' 31' ' ' ILE . 11.7 p -89.96 -43.3 14.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.262 -179.879 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.723 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -64.75 -24.7 36.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.871 179.853 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.706 HD23 ' N ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -70.84 -46.85 61.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.15 -179.844 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.706 ' N ' HD23 ' A' ' 32' ' ' LEU . 55.8 m -62.81 -25.98 68.51 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.42 -179.473 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.0 mt -90.04 -35.72 15.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.73 0.3 . . . . 0.0 111.544 -179.478 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.17 20.23 7.14 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.335 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.472 ' O ' ' CB ' ' A' ' 37' ' ' LYS . 3.2 mttm -118.43 -55.96 2.18 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.054 179.724 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.472 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 2.3 pttt 154.65 -20.41 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.0 179.565 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.66 ' HB3' HG23 ' A' ' 33' ' ' THR . 0.0 OUTLIER -65.31 120.72 70.02 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.163 -179.627 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.51 -178.74 4.7 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.476 2.118 . . . . 0.0 112.289 179.832 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.62 HD13 ' SG ' ' A' ' 59' ' ' CYS . 59.3 mt -92.31 108.66 20.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.929 179.843 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -58.74 161.6 8.16 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.98 -179.927 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -67.14 -33.25 31.93 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.461 2.107 . . . . 0.0 112.189 179.915 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -58.9 -21.07 56.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.106 179.854 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.432 ' CE2' ' HA ' ' A' ' 61' ' ' ILE . 3.5 m-85 -57.42 -21.78 38.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.136 179.961 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 64.44 66.57 0.6 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.988 0.423 . . . . 0.0 110.963 179.999 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -93.29 106.17 18.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.861 179.911 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 42.1 m80 -124.2 175.5 7.0 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.929 179.972 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -99.31 114.55 27.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.132 -179.967 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.657 HD11 ' HG3' ' A' ' 58' ' ' GLU . 3.3 mt -61.56 159.13 13.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.837 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.66 165.74 11.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.107 -179.928 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 58.39 108.21 0.01 OUTLIER Glycine 0 CA--C 1.507 -0.429 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.809 179.754 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.4 mptt 69.14 -46.15 0.56 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.628 0.252 . . . . 0.0 111.161 179.815 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 22.6 m95 -97.03 32.14 2.22 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.994 -179.894 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.434 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.2 OUTLIER -69.3 -51.86 16.47 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.087 179.891 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.434 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 98.9 Cg_endo -80.21 46.24 2.19 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.437 2.091 . . . . 0.0 112.522 179.933 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -156.52 175.66 13.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.852 0.358 . . . . 0.0 110.88 179.849 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.655 ' O ' HG13 ' A' ' 68' ' ' VAL . 14.7 ttm105 -137.79 144.04 41.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.919 -179.942 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.657 ' HG3' HD11 ' A' ' 49' ' ' LEU . 1.1 tt0 -105.35 177.31 4.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.975 -179.895 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.62 ' SG ' HD13 ' A' ' 40' ' ' LEU . 0.5 OUTLIER -168.26 126.09 1.12 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.68 -179.992 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.467 ' CE1' HD22 ' A' ' 66' ' ' LEU . 2.6 m-70 -102.19 82.69 2.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.07 -179.734 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.713 HG21 HG23 ' A' ' 30' ' ' VAL . 4.4 mp -59.99 -26.94 37.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.771 179.662 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.426 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 23.5 mtpp -139.82 169.25 12.51 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.566 179.927 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.426 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 12.2 Cg_exo -70.04 -0.19 6.78 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.802 2.335 . . . . 0.0 112.983 -179.86 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -143.33 27.61 1.55 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.875 179.877 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.83 ' O ' HD23 ' A' ' 66' ' ' LEU . 38.9 t -139.51 152.06 22.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.938 0.399 . . . . 0.0 111.311 179.992 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.83 HD23 ' O ' ' A' ' 65' ' ' VAL . 1.0 OUTLIER -148.17 100.54 3.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.552 179.804 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.775 HD12 ' N ' ' A' ' 68' ' ' VAL . 4.2 tp -97.48 131.32 44.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.059 -179.679 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.775 ' N ' HD12 ' A' ' 67' ' ' LEU . 57.1 t -106.14 136.75 39.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.891 179.793 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.612 ' CE1' HD11 ' A' ' 76' ' ' LEU . 45.3 p90 -153.55 164.04 38.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.136 -179.921 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.736 ' HB2' HD11 ' A' ' 77' ' ' ILE . 1.4 tp -106.39 174.46 5.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.864 179.916 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.4 t -123.86 123.23 66.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.26 -179.957 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 3.7 tptp -100.15 160.97 13.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.743 179.919 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -44.27 -49.46 9.35 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.54 -179.81 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -137.89 28.3 2.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.919 179.927 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 50.6 mp0 -156.88 170.0 23.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.824 179.96 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.612 HD11 ' CE1' ' A' ' 69' ' ' TYR . 0.7 OUTLIER -129.88 141.15 50.85 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.682 179.803 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.744 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.3 pp -128.95 131.55 68.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.396 -179.724 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 72.5 mt -73.43 158.44 34.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.599 179.77 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.84 -78.33 0.58 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.045 -179.885 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.72 167.06 29.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.013 0.435 . . . . 0.0 111.253 -179.909 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.868 HD13 ' N ' ' A' ' 82' ' ' GLY . 1.5 tm? -114.19 137.72 51.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.696 179.849 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.868 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -141.26 -176.32 15.52 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.675 -179.775 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -140.88 -176.15 4.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.812 0.339 . . . . 0.0 110.895 179.985 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -67.75 -27.78 67.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.167 -179.949 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.2 m -90.02 -27.57 19.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.099 -179.97 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.664 ' OE1' HD11 ' A' ' 17' ' ' LEU . 1.1 mt-10 -80.18 -75.11 0.27 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.842 0.353 . . . . 0.0 111.015 -179.798 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.552 HD12 ' HB2' ' A' ' 66' ' ' LEU . 29.6 mt -67.17 -38.43 85.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.023 -179.943 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.192 -0.908 . . . . 0.0 111.027 179.92 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.819 0.343 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 10.3 mt -96.34 161.95 13.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.92 179.905 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -66.56 160.89 24.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.819 179.987 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.9 tt -128.64 144.96 51.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.905 179.781 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.755 ' HB2' HG22 ' A' ' 77' ' ' ILE . 0.9 OUTLIER -141.48 163.33 33.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.859 -179.925 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.6 mp -124.63 125.55 44.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.858 179.998 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.604 ' HE3' HD13 ' A' ' 77' ' ' ILE . 58.8 mmtt -92.12 168.86 11.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.942 -179.969 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -60.33 -32.23 71.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.782 -179.97 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.3 m -70.83 -47.49 59.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.821 179.936 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.479 ' HE1' HD13 ' A' ' 67' ' ' LEU . 31.3 t80 -63.86 -30.7 71.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.959 -179.833 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -63.23 -46.16 88.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.996 -179.916 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.5 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 7.4 pttt -87.08 -5.6 58.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.597 -179.955 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.428 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -90.77 -15.74 29.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.082 179.778 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.889 ' O ' HD13 ' A' ' 18' ' ' LEU . 21.1 t80 -90.82 -74.33 0.5 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.633 -179.474 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.681 ' HA ' HD22 ' A' ' 18' ' ' LEU . 1.1 m-20 -79.65 -32.93 41.65 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -178.899 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.5 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.4 OUTLIER -75.41 -16.57 60.34 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.213 -179.656 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.428 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 32.7 tp -90.14 -37.41 14.22 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.402 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.889 HD13 ' O ' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -50.9 -42.95 59.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.066 179.962 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.5 pp -89.28 0.72 56.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.691 -179.531 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -98.05 32.07 2.52 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.741 0.305 . . . . 0.0 110.85 -179.965 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.79 22.97 40.54 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.503 -179.843 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.579 ' CD1' HD12 ' A' ' 18' ' ' LEU . 34.2 t80 -106.99 141.71 37.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.803 0.335 . . . . 0.0 110.769 179.834 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.889 ' O ' HG12 ' A' ' 26' ' ' VAL . 16.0 t70 -78.89 105.58 10.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.829 179.954 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.594 ' HA ' HD23 ' A' ' 27' ' ' LEU . 27.3 p30 -64.92 -14.26 59.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.455 -179.954 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.1 t -75.84 -20.99 57.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.606 0.241 . . . . 0.0 111.47 -179.866 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.889 HG12 ' O ' ' A' ' 23' ' ' ASP . 14.3 p -88.8 -27.14 5.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.71 0.291 . . . . 0.0 111.614 -179.633 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.609 HD13 ' HE1' ' A' ' 14' ' ' PHE . 1.5 pp -59.11 -37.92 78.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.84 0.352 . . . . 0.0 110.956 -179.855 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -56.89 -24.96 55.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.192 -179.842 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -78.73 -44.73 22.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.152 -179.964 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.532 HG13 HD12 ' A' ' 31' ' ' ILE . 11.5 p -80.58 -48.96 19.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.313 -179.857 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.532 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -54.0 -34.56 26.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 121.08 0.467 . . . . 0.0 110.228 179.45 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.817 HD23 ' N ' ' A' ' 33' ' ' THR . 0.9 OUTLIER -52.08 -61.34 2.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.317 179.471 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.817 ' N ' HD23 ' A' ' 32' ' ' LEU . 39.1 m -54.23 -26.81 30.64 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.564 -179.867 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 32.8 mt -70.44 -49.51 47.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.758 0.313 . . . . 0.0 111.149 -179.766 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.1 mtm180 -77.35 -55.89 5.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.99 0.424 . . . . 0.0 110.806 -179.802 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.736 ' HE2' HD21 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -64.12 -16.7 62.38 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.599 -179.967 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.553 ' CG ' ' O ' ' A' ' 36' ' ' LYS . 0.2 OUTLIER 53.35 73.06 0.39 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.332 179.807 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.672 ' HB3' HG23 ' A' ' 33' ' ' THR . 20.4 tt0 -84.11 139.09 39.42 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.138 178.781 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -58.56 105.0 0.2 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.451 2.101 . . . . 0.0 112.034 179.894 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 50.1 mt -62.48 178.78 0.38 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.013 -179.777 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -140.14 163.52 43.52 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.779 -179.985 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -64.24 -27.91 64.19 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.602 2.202 . . . . 0.0 112.291 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.25 -17.92 64.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.247 179.942 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.426 ' CD2' ' HA ' ' A' ' 61' ' ' ILE . 3.6 m-85 -69.49 -10.7 59.17 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.48 -179.988 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 61.89 36.89 15.63 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.893 0.378 . . . . 0.0 110.902 -179.959 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.2 p-10 -75.77 84.42 2.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.879 179.789 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 -140.48 -177.61 5.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.061 -179.921 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.9 157.23 33.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.162 -179.945 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.58 HD11 ' HG3' ' A' ' 58' ' ' GLU . 53.9 mt -105.3 -178.35 3.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.913 180.0 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -118.08 175.17 5.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.91 -179.879 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 71.81 -138.19 26.73 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.546 -179.954 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.18 -28.19 69.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.694 0.283 . . . . 0.0 111.0 179.98 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 8.1 m95 -97.32 39.26 1.2 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.726 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.462 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 3.1 tmtp? -69.51 -51.38 16.65 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.314 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.462 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 81.9 Cg_endo -78.67 6.6 4.75 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.449 2.1 . . . . 0.0 112.878 -179.787 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -105.39 173.38 6.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.842 0.354 . . . . 0.0 110.87 179.93 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.611 ' O ' HG13 ' A' ' 68' ' ' VAL . 23.1 ttm180 -131.74 142.9 49.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.979 -179.967 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.58 ' HG3' HD11 ' A' ' 49' ' ' LEU . 1.2 tt0 -110.75 171.67 7.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.985 -179.914 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 8.3 t -160.78 118.47 2.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.719 179.882 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.591 ' CE1' HD22 ' A' ' 66' ' ' LEU . 3.8 m-70 -94.4 78.7 3.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.977 -179.858 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.524 ' CB ' HG23 ' A' ' 30' ' ' VAL . 3.7 mp -57.06 -27.12 26.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.072 179.76 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.558 ' NZ ' HG22 ' A' ' 26' ' ' VAL . 10.5 mtmm -139.37 169.26 12.71 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.708 179.991 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.402 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 13.7 Cg_exo -69.19 -3.32 11.4 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.78 2.32 . . . . 0.0 112.875 -179.834 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -141.29 26.02 2.02 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.922 179.881 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.845 ' O ' HD23 ' A' ' 66' ' ' LEU . 56.9 t -136.64 147.11 27.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.173 179.97 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.845 HD23 ' O ' ' A' ' 65' ' ' VAL . 2.4 mt -144.31 97.98 3.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.647 179.846 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.743 HD12 ' N ' ' A' ' 68' ' ' VAL . 4.2 tp -94.15 127.81 40.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.979 -179.865 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.743 ' N ' HD12 ' A' ' 67' ' ' LEU . 46.6 t -105.08 136.35 39.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.727 179.769 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -147.89 153.67 39.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.054 179.964 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.773 ' HB2' HD11 ' A' ' 77' ' ' ILE . 3.6 tp -99.18 173.13 6.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.893 -179.995 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.424 ' HA ' HD12 ' A' ' 76' ' ' LEU . 21.5 t -123.68 102.94 12.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.181 -179.966 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 13.5 tptp -73.48 162.32 29.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.758 179.962 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -44.95 -43.33 8.92 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.376 -179.86 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -145.4 29.72 1.14 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.819 179.902 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.3 mp0 -157.39 167.99 28.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.802 -179.885 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.424 HD12 ' HA ' ' A' ' 71' ' ' VAL . 10.8 tp -120.19 139.13 53.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.797 179.902 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.773 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.3 pp -128.83 131.6 68.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.339 -179.806 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 71.9 mt -73.68 137.14 43.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.704 179.742 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.09 -72.01 0.63 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.021 -179.767 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.447 ' NH2' HG11 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -161.16 170.48 20.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.849 0.357 . . . . 0.0 111.32 -179.949 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.617 HD13 ' N ' ' A' ' 82' ' ' GLY . 1.9 tm? -122.77 125.33 45.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.93 -179.943 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.617 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -135.43 -162.11 9.56 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.464 179.93 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -148.08 155.26 41.27 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.125 0.488 . . . . 0.0 110.909 -179.994 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.537 ' HA ' HD11 ' A' ' 66' ' ' LEU . 1.0 OUTLIER -49.07 -28.14 3.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.359 -179.886 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 12.1 t -90.09 -22.13 21.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.152 179.823 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -82.71 -73.56 0.39 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.263 -179.83 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.696 ' CD1' HD12 ' A' ' 66' ' ' LEU . 1.1 mp -51.36 -33.8 31.22 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.289 -179.724 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.27 -0.871 . . . . 0.0 110.873 -179.994 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.423 ' HA ' ' HE3' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 120.809 0.338 . . . . 0.0 111.158 . . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.542 HD13 ' CB ' ' A' ' 76' ' ' LEU . 1.4 pp -164.95 175.73 9.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.873 179.949 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.31 150.89 24.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.913 -179.974 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.3 tp -125.16 138.33 54.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.8 179.923 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.736 ' HB2' HG22 ' A' ' 77' ' ' ILE . 1.1 t-20 -118.58 169.58 9.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.835 -179.954 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 33.3 mt -132.21 112.68 12.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.881 -179.961 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.31 161.68 18.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.908 -179.989 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.7 tptt -61.38 -34.46 75.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.825 -179.985 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 39.3 m -69.69 -32.6 71.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.777 179.958 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -73.52 -38.48 65.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.856 -179.965 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -63.34 -37.58 87.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.802 -179.993 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.577 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 1.8 mttp -83.9 -25.56 30.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.234 0.54 . . . . 0.0 111.055 -179.999 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.466 ' O ' ' HB3' ' A' ' 17' ' ' LEU . 1.2 m-20 -90.9 -9.42 46.31 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.067 179.805 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.829 ' CE1' HD13 ' A' ' 27' ' ' LEU . 47.5 t80 -91.26 -68.02 0.82 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.14 -179.604 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -91.05 -34.59 15.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.806 -179.331 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.577 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -78.68 -15.21 58.75 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.167 -179.48 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.466 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 31.6 tp -80.55 -35.18 34.74 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.957 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.704 HD13 ' CB ' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -64.01 -53.37 51.1 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.914 179.71 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.3 mt -60.08 -36.96 78.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.928 179.984 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -24.9 61.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.948 179.901 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.97 37.88 0.24 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.639 179.915 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.4 ' CB ' ' HG ' ' A' ' 17' ' ' LEU . 76.0 t80 -121.63 163.59 18.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.802 0.334 . . . . 0.0 110.866 -179.987 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -76.13 125.45 29.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.101 -179.854 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.704 ' CB ' HD13 ' A' ' 18' ' ' LEU . 7.6 p-10 -93.26 -15.82 25.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.191 179.741 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.1 m -78.83 -34.69 45.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.787 0.327 . . . . 0.0 111.047 -179.678 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 11.7 p -66.81 -27.38 39.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.389 -179.87 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.829 HD13 ' CE1' ' A' ' 14' ' ' PHE . 1.3 pp -64.78 -37.97 89.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.106 -179.803 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.801 ' O ' HD22 ' A' ' 32' ' ' LEU . 7.3 t-20 -61.52 -26.57 68.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.061 -179.988 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.412 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 2.2 mm-40 -74.81 -33.99 62.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.132 -179.869 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 1.11 HG23 HG21 ' A' ' 61' ' ' ILE . 11.7 p -90.65 -41.08 13.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.923 -179.645 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.699 HD12 HG13 ' A' ' 30' ' ' VAL . 1.5 mp -64.12 -54.91 25.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.718 -179.301 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.801 HD22 ' O ' ' A' ' 28' ' ' ASN . 0.8 OUTLIER -50.38 -22.53 1.89 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 -179.073 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.562 ' N ' HD23 ' A' ' 32' ' ' LEU . 38.9 m -90.29 -42.57 10.9 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 120.659 0.266 . . . . 0.0 111.545 -179.725 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.977 HD21 HD21 ' A' ' 40' ' ' LEU . 21.9 mt -80.46 -31.72 37.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.952 -179.023 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.533 ' CD ' HG23 ' A' ' 31' ' ' ILE . 5.9 mtp-105 -91.38 20.39 5.28 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -179.238 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.575 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 0.6 OUTLIER -115.51 -45.67 2.9 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.11 -0.236 . . . . 0.0 111.635 -179.969 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.511 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 1.0 OUTLIER 150.99 -20.59 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 122.883 0.473 . . . . 0.0 111.082 179.55 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.15 112.11 10.67 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.129 -179.64 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.49 152.88 34.44 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.452 2.101 . . . . 0.0 112.177 179.807 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.977 HD21 HD21 ' A' ' 34' ' ' LEU . 4.3 mt -76.68 115.76 16.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.826 -179.993 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.62 164.47 3.99 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.033 -179.864 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.62 -13.17 32.28 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.574 2.183 . . . . 0.0 112.604 179.943 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -83.57 3.61 31.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.407 -179.947 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -95.48 20.16 9.91 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.693 0.282 . . . . 0.0 111.181 179.999 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 58.0 mm-40 58.83 34.24 23.57 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.896 179.927 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.0 p-10 -82.9 114.88 21.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.892 -179.975 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -168.72 178.03 4.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.959 179.991 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.42 148.02 43.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.117 179.981 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.533 HD11 ' CG ' ' A' ' 58' ' ' GLU . 90.7 mt -102.4 -177.11 3.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.834 179.955 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.77 176.33 5.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.867 -179.915 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 67.93 -136.35 30.94 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.577 179.965 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.44 -25.84 68.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.718 0.295 . . . . 0.0 111.094 -179.869 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.435 ' HD1' HG11 ' A' ' 68' ' ' VAL . 18.5 m-90 -96.65 38.77 1.19 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.912 0.387 . . . . 0.0 110.984 -179.956 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.419 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.1 OUTLIER -73.13 -52.21 5.59 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.011 179.947 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 54' ' ' LYS . 88.4 Cg_endo -83.2 13.89 2.52 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.646 2.231 . . . . 0.0 112.803 179.973 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.411 ' CD2' ' HG ' ' A' ' 79' ' ' LEU . 96.1 m-85 -114.14 179.18 4.03 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.863 0.363 . . . . 0.0 110.999 -179.921 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.593 HH21 HG21 ' A' ' 71' ' ' VAL . 0.0 OUTLIER -131.14 149.8 52.43 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.886 -179.985 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.533 ' CG ' HD11 ' A' ' 49' ' ' LEU . 0.8 OUTLIER -129.91 169.87 14.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.923 -179.963 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.538 ' SG ' HD13 ' A' ' 40' ' ' LEU . 37.5 t -165.04 129.21 2.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.931 -179.951 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.414 ' CD2' ' HB3' ' A' ' 66' ' ' LEU . 23.5 m170 -91.84 83.24 5.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.848 179.837 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 1.11 HG21 HG23 ' A' ' 30' ' ' VAL . 3.5 mp -56.91 -50.93 73.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.122 -179.966 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.439 ' HB3' ' CD ' ' A' ' 63' ' ' PRO . 0.0 OUTLIER -114.82 172.41 3.64 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.483 179.965 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.439 ' CD ' ' HB3' ' A' ' 62' ' ' LYS . 16.7 Cg_exo -67.17 -4.28 11.34 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.554 2.169 . . . . 0.0 112.851 -179.874 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -146.81 29.09 1.02 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.874 179.933 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.791 ' O ' HD23 ' A' ' 66' ' ' LEU . 52.8 t -136.47 145.01 31.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.988 0.423 . . . . 0.0 111.383 179.934 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.791 HD23 ' O ' ' A' ' 65' ' ' VAL . 0.0 OUTLIER -159.13 111.22 2.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.595 179.745 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.488 HD12 ' O ' ' A' ' 68' ' ' VAL . 0.3 OUTLIER -111.68 139.03 47.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.875 0.369 . . . . 0.0 111.103 -179.745 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.488 ' O ' HD12 ' A' ' 67' ' ' LEU . 40.9 t -88.94 139.36 17.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.801 179.84 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.403 ' CD1' ' N ' ' A' ' 69' ' ' TYR . 2.3 p90 -153.84 175.58 13.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.037 -179.952 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.601 ' HB2' HD11 ' A' ' 77' ' ' ILE . 4.5 tp -130.16 150.13 51.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.888 179.979 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.593 HG21 HH21 ' A' ' 57' ' ' ARG . 21.6 t -106.97 111.43 35.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.109 179.988 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.68 168.72 9.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.89 179.963 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.21 108.78 1.14 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.93 -179.922 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.1 t0 57.98 24.2 10.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.069 179.885 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -160.02 141.21 12.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.817 179.989 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.542 ' CB ' HD13 ' A' ' 2' ' ' LEU . 0.5 OUTLIER -119.93 148.16 43.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.896 -179.972 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.736 HG22 ' HB2' ' A' ' 5' ' ' ASN . 2.1 pp -131.49 134.32 60.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.26 -179.913 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 62.7 mt -84.93 135.39 34.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.671 179.781 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.411 ' HG ' ' CD2' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -93.73 -61.43 1.55 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.045 -179.927 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.4 175.05 4.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.973 0.416 . . . . 0.0 111.297 179.955 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.873 HD13 ' N ' ' A' ' 82' ' ' GLY . 3.1 tm? -116.13 142.36 46.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.793 -179.971 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.873 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -148.5 -178.02 23.26 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.507 179.966 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 58.7 m -138.45 177.05 8.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.836 0.351 . . . . 0.0 110.907 179.944 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 8.4 t-80 -64.24 -29.99 71.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.943 -179.969 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.9 m -88.49 -29.95 19.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.895 -179.96 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.27 -68.13 0.55 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.886 -179.949 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.753 HD12 HD12 ' A' ' 66' ' ' LEU . 25.3 mt -69.7 -32.68 71.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.931 -179.979 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.938 179.983 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.1 mtm . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.717 0.294 . . . . 0.0 111.531 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 8.0 mt -76.97 176.57 8.51 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.889 0.376 . . . . 0.0 110.927 179.923 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.67 152.69 40.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.957 -179.966 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.444 HD11 HD21 ' A' ' 78' ' ' LEU . 2.7 tp -120.75 145.27 47.69 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.874 179.931 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.485 ' HB2' HG22 ' A' ' 77' ' ' ILE . 8.0 t30 -129.88 171.89 12.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.752 179.957 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.453 HD11 HH21 ' A' ' 35' ' ' ARG . 4.6 mp -140.79 119.97 12.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.829 179.997 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -93.58 -176.56 4.12 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.917 179.973 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.7 mmtt -74.18 -31.36 62.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.863 -179.972 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.57 -39.76 73.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.99 -179.96 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -71.95 -33.24 68.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.885 -179.951 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -59.42 -47.09 86.78 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.989 179.964 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.542 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 0.9 OUTLIER -80.34 -13.45 59.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.12 179.892 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.421 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 3.2 m-20 -90.72 -11.88 38.31 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.037 179.715 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.596 ' O ' HD13 ' A' ' 18' ' ' LEU . 76.6 t80 -90.69 -65.47 1.01 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.214 -179.612 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.782 ' HA ' HD22 ' A' ' 18' ' ' LEU . 1.8 t70 -91.36 -36.34 13.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.95 -179.324 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.542 ' HB2' ' HA ' ' A' ' 12' ' ' LYS . 2.0 mptt -72.37 -36.54 68.75 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.125 -179.046 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.548 ' O ' HD23 ' A' ' 17' ' ' LEU . 1.8 tt -61.06 -32.07 71.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.996 0.427 . . . . 0.0 109.908 179.15 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.782 HD22 ' HA ' ' A' ' 15' ' ' ASP . 0.2 OUTLIER -62.51 -23.49 66.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.146 179.89 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -90.06 15.05 10.84 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.446 -179.995 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -127.6 47.91 2.32 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.823 0.344 . . . . 0.0 110.844 -179.979 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.27 30.05 65.5 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.482 -179.923 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.523 ' CD1' HD12 ' A' ' 18' ' ' LEU . 8.6 t80 -120.73 124.55 45.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.784 0.326 . . . . 0.0 110.765 -179.921 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.435 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 25.5 t0 -79.53 140.47 37.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.204 -179.744 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.691 ' HA ' HD23 ' A' ' 27' ' ' LEU . 7.3 p-10 -93.68 16.35 14.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.388 -179.977 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.5 t -90.06 -33.51 16.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.76 0.314 . . . . 0.0 111.348 -179.741 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.3 t -84.14 -38.14 13.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.573 -179.623 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.691 HD23 ' HA ' ' A' ' 24' ' ' ASP . 0.4 OUTLIER -59.86 -36.6 77.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.16 -179.667 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.529 ' O ' HD12 ' A' ' 32' ' ' LEU . 26.9 t30 -52.23 -46.07 65.57 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.076 -179.927 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.532 ' C ' HD12 ' A' ' 32' ' ' LEU . 5.3 mt-10 -64.94 -16.65 63.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.115 179.794 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 95.2 t -90.36 -74.37 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.034 0.445 . . . . 0.0 111.658 -179.541 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.7 mp -45.72 -44.03 4.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.874 -0.603 . . . . 0.0 112.263 -179.005 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.939 HD13 ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -58.56 -19.65 39.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.72 0.295 . . . . 0.0 111.512 -179.431 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.939 ' N ' HD13 ' A' ' 32' ' ' LEU . 99.1 m -84.84 -28.74 25.85 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.83 0.348 . . . . 0.0 111.092 179.996 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.581 HD21 HD11 ' A' ' 40' ' ' LEU . 73.2 mt -89.9 -34.16 16.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.597 -179.349 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.453 HH21 HD11 ' A' ' 6' ' ' LEU . 4.5 mtp-105 -93.31 20.31 7.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.852 -179.346 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.592 ' HE3' HD23 ' A' ' 32' ' ' LEU . 10.3 mttm -110.04 -55.5 2.44 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 121.159 -0.216 . . . . 0.0 110.98 179.719 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.45 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 159.72 -20.53 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.27 179.613 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -83.38 118.33 71.25 Favored Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 116.713 -0.222 . . . . 0.0 111.083 -179.71 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -75.99 -179.39 5.16 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.462 2.108 . . . . 0.0 112.295 179.776 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.581 HD11 HD21 ' A' ' 34' ' ' LEU . 8.7 mt -98.89 157.35 16.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.779 179.968 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -96.56 157.75 34.84 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.024 -179.921 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.29 -3.28 13.68 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.632 2.221 . . . . 0.0 112.817 -179.982 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -92.6 17.71 9.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.694 0.283 . . . . 0.0 111.206 179.858 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -113.46 21.52 15.07 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.744 0.307 . . . . 0.0 110.985 179.901 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 62.79 43.92 6.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.828 179.986 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.7 p-10 -88.75 66.21 7.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.853 179.946 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -120.28 178.3 4.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.882 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.77 163.06 28.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.087 -179.991 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.777 HD21 ' OE1' ' A' ' 58' ' ' GLU . 5.4 mt -106.7 176.76 5.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.886 179.961 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.3 mmtt -116.67 157.07 26.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.041 179.989 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 82.68 -140.22 20.09 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.543 179.978 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm -58.47 -22.92 56.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.737 0.304 . . . . 0.0 111.219 179.999 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 5.0 m95 -96.17 38.48 1.19 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.928 179.953 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.435 ' N ' ' HD2' ' A' ' 55' ' ' PRO . 0.0 OUTLIER -75.4 -52.19 3.06 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.116 -179.922 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.435 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 90.1 Cg_endo -79.75 47.06 2.4 Favored 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 122.43 2.087 . . . . 0.0 112.347 -179.933 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.721 ' CD1' HD21 ' A' ' 79' ' ' LEU . 77.9 m-85 -154.57 178.37 10.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.856 179.878 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -137.17 134.76 36.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.004 -179.981 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.777 ' OE1' HD21 ' A' ' 49' ' ' LEU . 3.5 tt0 -98.8 171.85 7.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.79 179.891 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.535 ' SG ' HD13 ' A' ' 40' ' ' LEU . 14.8 t -168.36 116.66 0.71 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.901 179.985 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.557 ' CD2' HD22 ' A' ' 66' ' ' LEU . 11.3 m170 -93.31 79.04 4.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.915 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.585 HD11 ' HB3' ' A' ' 67' ' ' LEU . 2.5 mp -55.19 -26.87 19.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.193 179.843 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.425 ' HB3' ' HD2' ' A' ' 63' ' ' PRO . 2.7 mtpp -137.72 166.93 22.65 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.767 -179.751 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.425 ' HD2' ' HB3' ' A' ' 62' ' ' LYS . 48.2 Cg_endo -68.58 -2.57 9.51 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.351 2.034 . . . . 0.0 112.789 179.929 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -143.47 27.4 1.54 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.662 179.62 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.846 ' O ' HD23 ' A' ' 66' ' ' LEU . 60.9 t -136.9 146.38 28.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.208 -179.956 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.846 HD23 ' O ' ' A' ' 65' ' ' VAL . 5.8 mt -144.24 102.85 3.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.525 179.421 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.725 HD12 ' N ' ' A' ' 68' ' ' VAL . 5.2 tp -102.63 131.42 49.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.141 -179.651 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.725 ' N ' HD12 ' A' ' 67' ' ' LEU . 46.9 t -104.71 138.17 30.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.841 179.843 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.472 ' CD1' HD21 ' A' ' 76' ' ' LEU . 52.5 p90 -157.35 161.59 39.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.063 179.993 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.755 ' HB2' HD11 ' A' ' 77' ' ' ILE . 1.2 tp -109.36 -176.31 2.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.856 180.0 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.439 ' HA ' HD12 ' A' ' 76' ' ' LEU . 21.4 t -127.27 104.82 12.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.137 -179.99 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.62 172.61 8.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.871 179.923 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -57.99 102.55 0.11 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.906 179.893 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 58.17 24.75 11.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.961 -179.899 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -151.53 162.49 40.88 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.803 180.0 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.472 HD21 ' CD1' ' A' ' 69' ' ' TYR . 8.1 tp -123.41 147.66 46.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.832 -179.935 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.755 HD11 ' HB2' ' A' ' 70' ' ' LEU . 2.4 pp -131.95 128.92 60.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.154 -179.885 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.444 HD21 HD11 ' A' ' 4' ' ' LEU . 70.1 mt -73.83 155.4 38.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.684 179.744 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.721 HD21 ' CD1' ' A' ' 56' ' ' PHE . 0.3 OUTLIER -117.21 -68.16 0.94 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.94 -179.909 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.81 166.75 29.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.09 179.966 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.836 HD13 ' N ' ' A' ' 82' ' ' GLY . 2.2 tm? -121.27 137.85 54.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.824 -179.952 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.836 ' N ' HD13 ' A' ' 81' ' ' LEU . . . -154.83 -164.67 13.18 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.638 -179.988 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.9 p -142.57 176.67 8.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.892 0.377 . . . . 0.0 110.875 179.997 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 26.7 t-80 -59.27 -27.5 65.87 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.049 -179.904 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.6 m -78.85 -28.89 44.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.087 -179.878 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.412 ' HB3' HD12 ' A' ' 87' ' ' LEU . 1.2 tt0 -84.24 -72.98 0.44 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.023 -179.963 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.46 ' H ' HD12 ' A' ' 87' ' ' LEU . 6.6 mp -60.72 -39.93 90.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.021 -179.964 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.9 -179.961 . . . . . . . . 0 0 . 1 stop_ save_