data_2b7e_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 2b7e _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 ' 3' ' ' MET . . . . . . . . . . . . . 69.5 mtm . . . . . 0 C--O 1.234 0.26 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -61.25 -46.52 90.05 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.5 0.667 . . . . 0.0 110.522 -178.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.573 ' HB3' ' HB ' ' A' ' 41' ' ' VAL . . . -59.33 -47.36 85.71 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 114.479 -1.237 . . . . 0.0 111.577 -179.295 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -63.33 -47.18 83.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.997 0.427 . . . . 0.0 110.895 -178.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -52.31 -54.22 34.24 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.066 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.4 ' O ' ' HG2' ' A' ' 12' ' ' MET . 29.7 mm-40 -64.72 -36.46 84.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.273 178.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.622 ' O ' HD22 ' A' ' 13' ' ' LEU . 24.9 t80 -61.41 -37.78 84.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.373 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.488 ' CD1' ' HE2' ' A' ' 51' ' ' MET . 23.7 mm -68.71 -38.65 79.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.131 0.491 . . . . 0.0 110.264 177.067 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.8 m -69.53 -41.67 75.68 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.573 -177.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.507 ' SD ' ' HA ' ' A' ' 9' ' ' PHE . 24.1 ptm -69.11 -26.81 65.1 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 -179.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.622 HD22 ' O ' ' A' ' 9' ' ' PHE . 1.3 mm? -69.27 -38.31 78.31 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.36 179.038 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -70.89 -42.33 70.13 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.03 0.443 . . . . 0.0 110.531 174.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -69.34 -28.89 66.62 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.169 -176.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.405 HD21 ' N ' ' A' ' 16' ' ' ASN . 0.9 OUTLIER -85.81 8.65 19.2 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.929 0.395 . . . . 0.0 110.09 175.473 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 59.61 32.5 21.6 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 115.265 -0.879 . . . . 0.0 112.616 175.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.491 HG21 HD12 ' A' ' 13' ' ' LEU . 41.5 t -77.43 141.72 15.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.949 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -154.01 -159.71 1.01 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.95 172.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.68 ' HA ' HD22 ' A' ' 56' ' ' LEU . 16.9 m -60.25 -27.01 66.89 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -176.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 41.5 p -85.3 45.91 1.23 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 121.181 0.515 . . . . 0.0 111.563 -178.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.574 ' CE2' ' HD3' ' A' ' 26' ' ' ARG . 5.5 m95 -139.61 146.82 40.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.607 -177.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 93.7 p -105.12 170.22 8.0 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 170.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.432 ' CE1' ' HB3' ' A' ' 48' ' ' LYS . 61.4 t80 -85.2 15.37 4.28 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 122.133 0.968 . . . . 0.0 109.454 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.9 t -92.75 -41.02 10.36 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 113.859 -1.519 . . . . 0.0 107.335 172.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.574 ' HD3' ' CE2' ' A' ' 22' ' ' TRP . 18.1 ttt180 -65.74 -32.86 74.63 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 114.327 -1.306 . . . . 0.0 109.635 177.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.709 HG21 HD22 ' A' ' 31' ' ' LEU . 33.4 mt -63.08 -54.46 33.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.198 174.383 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.5 mt -62.37 -32.71 55.9 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 120.411 -0.515 . . . . 0.0 111.893 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.51 ' HG ' ' HG2' ' A' ' 30' ' ' GLU . 96.9 p -85.51 -37.89 19.17 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -174.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.51 ' HG2' ' HG ' ' A' ' 29' ' ' SER . 40.0 mm-40 -101.56 -35.75 9.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.902 0.382 . . . . 0.0 111.497 -174.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.709 HD22 HG21 ' A' ' 27' ' ' ILE . 5.3 mp -86.43 -16.33 37.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.388 0.613 . . . . 0.0 109.662 -174.432 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -81.05 -3.79 90.62 Favored Glycine 0 N--CA 1.442 -0.933 0 CA-C-N 115.199 -0.909 . . . . 0.0 111.904 177.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 41.3 p -129.04 -38.25 1.64 Allowed 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -176.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.456 ' HE ' ' HB3' ' A' ' 30' ' ' GLU . 89.9 mtt-85 -54.84 -45.63 74.53 Favored 'General case' 0 C--O 1.232 0.174 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -176.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.41 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 2.8 p30 -155.92 138.95 10.75 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 172.429 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.49 ' O ' ' HG3' ' A' ' 40' ' ' MET . 16.7 Cg_exo -68.98 14.45 0.2 Allowed 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 123.457 2.771 . . . . 0.0 114.474 -171.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 43.3 mtm180 -63.35 -28.72 70.19 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 122.128 -0.357 . . . . 0.0 111.043 177.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -68.02 -17.44 64.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.387 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 56.2 m95 -106.95 -24.37 12.04 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.921 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.49 ' HG3' ' O ' ' A' ' 36' ' ' PRO . 89.2 mtp -56.14 -49.89 72.67 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 174.185 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.573 ' HB ' ' HB3' ' A' ' 5' ' ' ALA . 2.9 p -86.25 123.37 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.354 -0.839 . . . . 0.0 108.77 169.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -58.58 144.32 43.22 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-O 121.729 0.776 . . . . 0.0 111.275 -174.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.521 ' HA ' ' HZ2' ' A' ' 48' ' ' LYS . 8.0 p-10 -73.12 97.32 2.35 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 114.726 -1.124 . . . . 0.0 111.987 -171.124 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -103.05 97.98 10.76 Favored Pre-proline 0 C--N 1.318 -0.766 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 164.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.68 ' O ' ' HB3' ' A' ' 49' ' ' LYS . 17.3 Cg_exo -66.74 -22.21 50.23 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.302 2.001 . . . . 0.0 112.417 -172.51 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 46' ' ' LEU . 0.3 OUTLIER -82.3 -37.82 25.24 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 179.586 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 45.4 t90 -74.68 -38.75 62.32 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.54 175.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.591 ' HG3' ' CZ ' ' A' ' 9' ' ' PHE . 1.4 mptm? -61.18 -32.41 72.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.035 0.445 . . . . 0.0 110.138 176.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.68 ' HB3' ' O ' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -88.59 -33.07 17.8 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.763 -176.493 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -62.9 -47.94 81.12 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.378 0.608 . . . . 0.0 110.257 171.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.488 ' HE2' ' CD1' ' A' ' 10' ' ' ILE . 1.5 ppp? -71.63 -24.12 61.81 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.032 -176.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.536 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 20.3 t80 -69.25 -36.45 77.16 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.095 174.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -65.9 -28.22 68.78 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.184 0.516 . . . . 0.0 109.943 174.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 10.1 tttm -72.58 -37.15 68.26 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.408 172.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.493 ' HA ' ' HA ' ' A' ' 59' ' ' ARG . 63.5 t80 -72.39 -18.8 61.7 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.125 0.488 . . . . 0.0 110.983 -179.114 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.68 HD22 ' HA ' ' A' ' 20' ' ' SER . 72.9 mt -92.28 -32.63 14.95 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 120.839 0.352 . . . . 0.0 111.073 176.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.3 t -85.68 -48.99 8.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.964 0.411 . . . . 0.0 110.754 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -102.6 -45.24 5.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.904 -179.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.493 ' HA ' ' HA ' ' A' ' 55' ' ' TYR . 40.3 ttm180 . . . . . 0 C--O 1.249 1.03 0 CA-C-O 117.957 -1.021 . . . . 0.0 110.733 178.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.536 ' O ' ' HG3' ' A' ' 7' ' ' LYS . 26.6 mmt . . . . . 0 CA--C 1.52 -0.182 0 CA-C-O 120.727 0.299 . . . . 0.0 111.248 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -68.76 -31.69 70.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.003 0.43 . . . . 0.0 109.963 -178.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.653 ' HB3' ' HB ' ' A' ' 41' ' ' VAL . . . -61.65 -44.47 96.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.723 176.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -61.45 -47.32 86.24 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 121.076 0.465 . . . . 0.0 110.466 175.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.536 ' HG3' ' O ' ' A' ' 3' ' ' MET . 48.9 mtpt -55.96 -49.48 73.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.405 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -65.04 -31.16 72.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.851 0.358 . . . . 0.0 110.949 178.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.529 ' HA ' ' HE3' ' A' ' 12' ' ' MET . 1.4 t80 -69.84 -40.21 75.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.94 -179.38 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.5 mm -73.5 -37.16 49.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.185 0.517 . . . . 0.0 110.144 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 26.8 m -65.56 -31.97 73.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.402 176.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.529 ' HE3' ' HA ' ' A' ' 9' ' ' PHE . 24.0 ttp -75.06 -33.91 61.76 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 115.322 -0.853 . . . . 0.0 108.944 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.456 HD12 HG12 ' A' ' 18' ' ' VAL . 0.2 OUTLIER -68.85 -38.88 80.07 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.835 -179.017 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.4 mppt? -73.89 -32.55 63.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.871 0.367 . . . . 0.0 110.904 177.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -69.2 -20.62 63.98 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.585 176.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -106.65 17.48 23.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.657 -0.247 . . . . 0.0 111.471 179.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.1 mm100 53.6 30.98 11.69 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.592 175.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.456 HG12 HD12 ' A' ' 13' ' ' LEU . 58.7 t -68.5 136.84 25.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.742 -177.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.437 ' CG ' ' H ' ' A' ' 20' ' ' SER . 5.6 t70 -148.62 -156.37 0.71 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 177.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.437 ' H ' ' CG ' ' A' ' 19' ' ' ASP . 9.8 p -74.37 -15.07 60.94 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.003 -176.081 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.3 t -83.13 -3.45 57.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.412 0.625 . . . . 0.0 110.739 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.561 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 6.0 m95 -92.18 128.32 37.99 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.112 176.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 70.8 p -95.71 174.63 6.88 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.49 -0.929 . . . . 0.0 108.49 170.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.522 ' CD1' HD11 ' A' ' 27' ' ' ILE . 27.8 t80 -86.5 15.18 5.74 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.132 178.246 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.8 t -93.23 -33.14 14.09 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 113.897 -1.501 . . . . 0.0 107.211 171.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.561 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 31.6 ttt180 -72.58 -33.71 66.94 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.285 176.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.552 HG23 HD22 ' A' ' 31' ' ' LEU . 45.8 mt -65.12 -39.13 84.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.509 176.048 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 72.8 mt -76.27 -44.0 36.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 C-N-CA 119.594 -0.842 . . . . 0.0 111.572 173.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 99.0 p -74.38 -38.07 63.26 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -171.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.551 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 50.2 mm-40 -109.96 -37.64 5.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.224 0.535 . . . . 0.0 111.226 -177.08 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.552 HD22 HG23 ' A' ' 27' ' ' ILE . 11.6 tp -87.84 -12.78 43.91 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.857 -162.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -83.28 -15.68 71.13 Favored Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.47 -0.872 . . . . 0.0 111.719 176.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.4 p -120.28 -26.96 5.34 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.551 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 46.5 mtt180 -57.12 -40.01 76.23 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.618 0.247 . . . . 0.0 111.104 178.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.486 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 8.8 t70 -152.58 129.89 5.79 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.412 179.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 22.3 Cg_exo -66.37 -0.89 4.74 Favored 'Trans proline' 0 CA--C 1.531 0.357 0 C-N-CA 123.658 2.905 . . . . 0.0 113.824 -177.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.416 ' HE ' ' CG ' ' A' ' 35' ' ' ASP . 68.2 mtm180 -61.36 -21.27 63.88 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 175.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -68.07 -18.67 64.74 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.221 0.534 . . . . 0.0 109.795 175.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 53.5 m95 -104.35 -17.29 14.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.409 -176.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 32.6 tpp -60.84 -38.55 85.86 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 121.243 0.544 . . . . 0.0 109.564 176.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.653 ' HB ' ' HB3' ' A' ' 5' ' ' ALA . 7.2 p -93.61 139.36 18.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.123 171.355 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -64.6 145.69 55.79 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-O 121.727 0.775 . . . . 0.0 111.778 -176.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -68.39 96.68 0.69 Allowed 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.155 -1.384 . . . . 0.0 112.051 -171.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.49 ' O ' ' HD3' ' A' ' 48' ' ' LYS . 9.8 t70 -122.24 98.31 44.43 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 114.877 -1.056 . . . . 0.0 108.623 169.074 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.401 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 41.2 Cg_exo -60.52 -32.49 93.65 Favored 'Trans proline' 0 CA--C 1.516 -0.409 0 C-N-CA 122.937 2.425 . . . . 0.0 112.758 -174.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.68 -38.35 58.77 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.952 -178.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . 0.498 ' CZ3' HG22 ' A' ' 41' ' ' VAL . 71.2 t90 -73.2 -36.6 66.55 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.896 -0.321 . . . . 0.0 110.147 174.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.49 ' HE2' ' HE2' ' A' ' 9' ' ' PHE . 2.3 mptm? -61.07 -34.1 74.37 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.717 -0.393 . . . . 0.0 109.944 176.227 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.48 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 33.3 mttt -78.72 -40.66 32.97 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 120.875 0.369 . . . . 0.0 110.59 178.329 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -65.96 -43.41 88.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.414 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.457 ' HE3' ' HB2' ' A' ' 51' ' ' MET . 2.8 ppp? -73.28 -29.02 62.44 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 -178.796 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -69.79 -37.95 76.51 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.423 176.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' A' ' 49' ' ' LYS . 92.5 mt-10 -69.6 -26.5 64.48 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 175.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 40.8 tptt -72.98 -37.52 67.0 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.224 0.535 . . . . 0.0 109.618 174.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.452 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 80.1 t80 -63.18 -30.4 71.55 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.684 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 64.6 mt -89.97 -32.83 16.62 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.408 179.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.4 t -79.79 -48.71 13.13 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.878 0.37 . . . . 0.0 111.466 -178.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -100.79 -45.76 5.36 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.547 -176.106 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.452 ' HG2' ' O ' ' A' ' 55' ' ' TYR . 3.1 mmt180 . . . . . 0 C--O 1.249 1.066 0 O-C-N 123.89 0.744 . . . . 0.0 110.751 176.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 68.8 mtm . . . . . 0 CA--C 1.521 -0.154 0 CA-C-O 120.495 0.188 . . . . 0.0 110.886 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -57.07 -42.98 81.64 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.402 0.62 . . . . 0.0 109.934 175.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.596 ' HB3' ' HB ' ' A' ' 41' ' ' VAL . . . -60.43 -47.29 86.75 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 114.746 -1.115 . . . . 0.0 111.129 178.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -59.15 -49.71 76.84 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.107 0.479 . . . . 0.0 110.395 178.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.424 ' HD2' ' HA ' ' A' ' 7' ' ' LYS . 12.9 mmmm -54.54 -44.85 73.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.945 -179.262 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.427 ' HB3' ' HD3' ' A' ' 37' ' ' ARG . 40.9 mt-10 -75.88 -25.53 56.22 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.036 179.421 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.477 ' HA ' ' HE3' ' A' ' 12' ' ' MET . 12.8 t80 -72.31 -39.9 67.9 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.828 178.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.615 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 39.2 mm -68.57 -38.73 79.52 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.222 0 CA-C-O 121.389 0.614 . . . . 0.0 109.939 177.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.0 m -67.62 -29.68 69.06 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.049 176.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.477 ' HE3' ' HA ' ' A' ' 9' ' ' PHE . 42.7 ttp -77.24 -29.43 54.07 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.334 -178.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.453 HD11 HG12 ' A' ' 18' ' ' VAL . 0.2 OUTLIER -71.21 -38.58 72.03 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.733 179.367 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.615 ' HD3' ' O ' ' A' ' 10' ' ' ILE . 0.3 OUTLIER -74.38 -31.89 62.54 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.691 176.775 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -63.43 -32.09 73.43 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.354 175.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -98.15 10.28 40.9 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.485 -177.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 55.4 mm-40 58.11 31.92 21.34 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.911 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.453 HG12 HD11 ' A' ' 13' ' ' LEU . 65.1 t -69.92 123.31 23.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.617 -176.19 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -142.07 -159.45 0.97 Allowed 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 170.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.5 t -59.02 -17.32 24.09 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -176.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.2 t -77.67 -3.78 42.79 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 122.133 -0.354 . . . . 0.0 111.414 178.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.527 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 7.8 m95 -99.43 138.1 37.0 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.234 176.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 87.7 p -110.5 178.91 4.23 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 170.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.529 ' CD1' HD12 ' A' ' 27' ' ' ILE . 15.9 t80 -86.14 16.69 4.1 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.999 0.904 . . . . 0.0 109.272 178.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.7 t -93.48 -38.18 11.55 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 169.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.527 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 29.3 ttt180 -71.56 -33.32 69.01 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 114.049 -1.432 . . . . 0.0 109.166 177.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.542 HG12 HD22 ' A' ' 31' ' ' LEU . 29.3 mt -64.92 -50.24 75.97 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.391 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.121 173.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.461 HG12 ' O ' ' A' ' 24' ' ' PHE . 44.6 mm -62.59 -43.19 98.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 119.822 -0.751 . . . . 0.0 111.198 177.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 48.4 t -70.58 -38.59 74.08 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -176.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.478 ' HB3' ' HE ' ' A' ' 34' ' ' ARG . 20.4 mm-40 -113.83 -34.95 5.29 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -171.196 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.542 HD22 HG12 ' A' ' 27' ' ' ILE . 0.5 OUTLIER -87.65 -26.36 23.06 Favored 'General case' 0 C--N 1.319 -0.754 0 O-C-N 121.771 -0.581 . . . . 0.0 111.01 -175.106 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -86.1 9.19 70.5 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.707 -0.759 . . . . 0.0 111.518 175.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 46.0 p -132.02 -54.0 0.98 Allowed 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -177.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.478 ' HE ' ' HB3' ' A' ' 30' ' ' GLU . 65.9 mtt-85 -52.87 -46.06 67.74 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -177.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.48 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 9.3 t70 -139.21 132.84 15.86 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.999 -171.071 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.48 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 17.3 Cg_exo -68.29 -2.21 8.6 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 123.32 2.68 . . . . 0.0 113.35 -178.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.65 ' HG2' ' HE3' ' A' ' 40' ' ' MET . 48.0 mtm180 -56.13 -30.32 61.96 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 176.321 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.407 ' CE1' ' HD2' ' A' ' 48' ' ' LYS . 67.7 t80 -69.5 -21.76 63.65 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.767 0.318 . . . . 0.0 110.393 178.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 62.6 m95 -104.08 -19.98 13.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.93 -174.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.65 ' HE3' ' HG2' ' A' ' 37' ' ' ARG . 38.2 mtm -60.8 -39.64 89.66 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.474 0.654 . . . . 0.0 109.559 177.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.596 ' HB ' ' HB3' ' A' ' 5' ' ' ALA . 5.2 p -88.38 130.65 37.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.102 -0.953 . . . . 0.0 108.664 169.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.23 136.74 58.05 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-O 121.447 0.642 . . . . 0.0 109.637 178.061 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.402 ' O ' ' HD3' ' A' ' 45' ' ' PRO . 29.5 t70 -75.88 96.47 3.72 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 114.882 -1.053 . . . . 0.0 112.091 -166.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -100.84 95.91 5.02 Favored Pre-proline 0 C--N 1.321 -0.643 0 N-CA-C 107.113 -1.439 . . . . 0.0 107.113 165.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.602 ' HA ' ' HB2' ' A' ' 48' ' ' LYS . 19.4 Cg_exo -67.11 -23.56 45.8 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 122.421 2.08 . . . . 0.0 112.107 -171.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -71.24 -38.32 71.95 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 56.4 t90 -75.72 -38.27 58.7 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 172.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.602 ' HB2' ' HA ' ' A' ' 45' ' ' PRO . 27.0 mmtp -61.01 -35.81 77.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.328 179.171 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.513 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 43.8 mttt -80.38 -40.29 26.81 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.669 179.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -66.14 -37.95 86.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.321 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 1.3 ppp? -71.73 -32.85 68.18 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.485 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 35.6 t80 -71.01 -37.96 72.65 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.665 176.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.513 ' HG2' ' O ' ' A' ' 49' ' ' LYS . 24.2 mm-40 -66.51 -30.84 71.25 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 175.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -72.45 -37.96 68.4 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.2 178.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.667 ' HA ' ' HA ' ' A' ' 59' ' ' ARG . 75.7 t80 -70.98 -24.51 62.41 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.75 -177.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 82.8 mt -87.95 -34.02 18.24 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.791 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.6 p -86.35 -41.11 14.79 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.952 0.406 . . . . 0.0 111.407 -178.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -118.13 -42.17 2.82 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.163 -176.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.667 ' HA ' ' HA ' ' A' ' 55' ' ' TYR . 39.0 ttm180 . . . . . 0 C--O 1.247 0.943 0 CA-C-O 118.123 -0.942 . . . . 0.0 110.378 -177.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.484 ' O ' ' HG2' ' A' ' 7' ' ' LYS . 34.4 mmt . . . . . 0 CA--C 1.518 -0.264 0 CA-C-O 120.631 0.253 . . . . 0.0 110.336 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -68.15 -35.0 77.36 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 176.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.506 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -64.25 -41.21 97.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.388 175.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.491 ' O ' HG12 ' A' ' 10' ' ' ILE . 29.8 tt0 -57.39 -47.03 82.74 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.038 176.572 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.561 ' HE2' ' N ' ' A' ' 7' ' ' LYS . 9.4 mmpt? -52.5 -52.35 54.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.446 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -62.78 -39.02 92.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.551 178.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.513 ' CE2' ' HG3' ' A' ' 48' ' ' LYS . 16.2 t80 -63.11 -39.48 94.81 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.465 -178.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.573 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 47.4 mm -74.31 -37.11 44.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.183 0.516 . . . . 0.0 110.226 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 29.9 m -64.11 -34.82 78.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.597 0.713 . . . . 0.0 110.289 176.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.457 ' HE2' ' HA ' ' A' ' 9' ' ' PHE . 33.4 ttp -75.93 -30.68 58.8 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.281 179.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.404 HD13 HG11 ' A' ' 18' ' ' VAL . 0.1 OUTLIER -70.36 -38.41 74.77 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.042 179.128 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.573 ' HD3' ' O ' ' A' ' 10' ' ' ILE . 0.0 OUTLIER -72.18 -33.48 67.7 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.756 0.313 . . . . 0.0 110.485 176.258 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -66.19 -26.76 67.55 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 121.288 0.566 . . . . 0.0 111.511 176.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 -102.02 14.57 31.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.785 -177.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 53.95 31.42 13.39 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.849 175.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.436 ' O ' ' HE2' ' A' ' 55' ' ' TYR . 66.4 t -67.12 136.06 27.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.245 0.545 . . . . 0.0 111.634 -173.082 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -157.94 -160.21 0.89 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.349 175.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 p -55.51 -24.39 31.47 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 123.383 0.427 . . . . 0.0 112.098 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.6 p -69.96 -11.17 60.67 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 120.972 0.415 . . . . 0.0 112.0 -179.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.579 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 11.5 m95 -95.75 133.83 39.39 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.169 0.509 . . . . 0.0 110.969 179.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 m -105.86 168.54 9.05 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 168.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.576 ' CD1' HD13 ' A' ' 27' ' ' ILE . 18.9 t80 -82.5 15.78 2.39 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 122.087 0.946 . . . . 0.0 109.912 -176.261 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.6 t -92.84 -34.3 13.89 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.173 -1.376 . . . . 0.0 107.674 170.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.579 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 40.8 ttt180 -70.14 -36.14 74.56 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.618 -1.174 . . . . 0.0 108.99 178.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.6 HG22 HD21 ' A' ' 31' ' ' LEU . 52.4 mt -64.77 -47.14 89.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.334 176.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.6 mt -70.51 -42.79 78.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 C-N-CA 119.546 -0.861 . . . . 0.0 111.705 177.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.3 t -77.55 -39.02 47.35 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -171.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.489 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 22.9 mm-40 -111.52 -35.39 5.81 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 121.077 0.465 . . . . 0.0 111.345 -174.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.6 HD21 HG22 ' A' ' 27' ' ' ILE . 11.4 tp -84.87 -36.67 21.39 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.478 -168.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -68.07 -17.42 69.83 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.763 174.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 65.1 p -107.1 -1.9 21.54 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 122.452 -0.44 . . . . 0.0 111.564 -178.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.489 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 60.3 mtt-85 -88.99 -47.37 8.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.542 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.511 ' OD1' ' HG3' ' A' ' 37' ' ' ARG . 11.8 t70 -149.32 137.41 11.71 Favored Pre-proline 0 C--N 1.325 -0.469 0 C-N-CA 120.904 -0.319 . . . . 0.0 111.222 -172.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.497 ' HA ' ' HD1' ' A' ' 39' ' ' TRP . 34.2 Cg_exo -63.32 -7.02 11.15 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.681 2.92 . . . . 0.0 113.959 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.511 ' HG3' ' OD1' ' A' ' 35' ' ' ASP . 47.0 mtm180 -56.41 -28.79 60.4 Favored 'General case' 0 CA--C 1.529 0.146 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 174.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -71.96 -20.27 61.76 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.816 0.341 . . . . 0.0 110.686 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.497 ' HD1' ' HA ' ' A' ' 36' ' ' PRO . 56.7 m95 -106.81 -23.53 12.36 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.436 -175.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 39.3 ttm -51.91 -47.3 64.68 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 121.36 0.6 . . . . 0.0 109.951 175.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.559 HG11 ' HZ2' ' A' ' 48' ' ' LYS . 2.5 p -87.43 116.67 30.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 167.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -58.19 145.42 37.23 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 121.464 0.649 . . . . 0.0 110.98 -173.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -63.33 98.09 0.15 Allowed 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.25 -1.341 . . . . 0.0 113.909 -164.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -111.11 95.94 27.65 Favored Pre-proline 0 N--CA 1.426 -1.628 0 CA-C-N 113.121 -1.854 . . . . 0.0 108.97 166.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_exo -67.71 -32.87 29.28 Favored 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 122.663 2.242 . . . . 0.0 112.662 -173.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.682 ' HA ' ' HE3' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -70.63 -36.39 73.44 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.881 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . 0.508 ' O ' ' HG2' ' A' ' 51' ' ' MET . 39.6 t90 -74.2 -39.27 63.26 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 119.608 -0.837 . . . . 0.0 110.111 175.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.559 ' HZ2' HG11 ' A' ' 41' ' ' VAL . 0.0 OUTLIER -63.83 -32.77 74.39 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 176.312 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.682 ' HE3' ' HA ' ' A' ' 46' ' ' LEU . 12.0 ptpt -78.72 -38.59 38.62 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.136 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -68.52 -42.03 79.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.642 179.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.508 ' HG2' ' O ' ' A' ' 47' ' ' TRP . 15.6 ptm -74.22 -26.65 60.38 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.528 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 39.8 t80 -70.33 -37.15 74.63 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-N 115.938 -0.573 . . . . 0.0 109.605 175.03 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -66.57 -30.85 71.25 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.941 175.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -72.85 -37.39 67.43 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-O 121.353 0.597 . . . . 0.0 109.904 177.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.436 ' HE2' ' O ' ' A' ' 18' ' ' VAL . 75.1 t80 -71.49 -24.71 62.03 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.643 -178.094 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 40.2 mt -93.7 -33.47 13.63 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.369 178.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 21.2 t -100.06 25.06 7.8 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.36 0.6 . . . . 0.0 110.664 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -171.11 -66.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.051 177.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 55' ' ' TYR . 36.6 ttm180 . . . . . 0 C--O 1.249 1.038 0 O-C-N 124.333 1.02 . . . . 0.0 109.543 -172.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 18.6 ttt . . . . . 0 N--CA 1.448 -0.559 0 CA-C-O 121.583 0.706 . . . . 0.0 110.007 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -62.7 -44.04 97.26 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.028 178.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.646 ' HB2' ' HB ' ' A' ' 41' ' ' VAL . . . -60.31 -45.03 94.81 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.24 177.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.434 ' O ' HG12 ' A' ' 10' ' ' ILE . 29.2 tt0 -57.34 -54.39 47.38 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 121.131 0.491 . . . . 0.0 110.254 177.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.1 ttpt -50.15 -50.35 49.19 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.009 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -61.09 -40.18 92.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.046 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.604 ' CZ ' ' HG3' ' A' ' 48' ' ' LYS . 25.4 t80 -67.38 -40.1 85.68 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.91 -177.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.46 HG23 ' HE3' ' A' ' 14' ' ' LYS . 40.1 mm -74.88 -36.34 38.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.28 0.562 . . . . 0.0 110.284 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.4 m -71.38 -28.11 63.8 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.406 177.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.574 ' HE2' ' HA ' ' A' ' 9' ' ' PHE . 27.2 ttp -74.47 -34.6 63.16 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 177.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.423 HD12 HG13 ' A' ' 18' ' ' VAL . 0.1 OUTLIER -68.59 -38.03 80.31 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.04 178.396 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.46 ' HE3' HG23 ' A' ' 10' ' ' ILE . 33.6 mttt -68.81 -43.15 76.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.205 0.526 . . . . 0.0 111.04 176.504 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -66.08 -29.64 70.01 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.025 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -91.68 11.19 25.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.657 0.265 . . . . 0.0 111.087 177.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 55.29 31.84 17.43 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.535 176.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.423 HG13 HD12 ' A' ' 13' ' ' LEU . 58.7 t -65.73 130.04 30.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.405 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -140.87 -164.15 1.68 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.429 176.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.2 p -56.21 -28.31 57.85 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -178.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 79.6 p -75.39 -6.77 51.7 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.027 0.441 . . . . 0.0 111.999 -176.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.74 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 9.8 m95 -89.38 126.08 35.4 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.112 0.482 . . . . 0.0 111.442 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.449 ' C ' ' H ' ' A' ' 25' ' ' SER . 30.4 t -83.89 155.65 22.79 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 167.54 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.563 ' CZ ' ' HB3' ' A' ' 48' ' ' LYS . 91.0 t80 -81.0 15.35 1.87 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-O 122.709 1.242 . . . . 0.0 109.356 -179.026 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.449 ' H ' ' C ' ' A' ' 23' ' ' SER . 15.1 t -92.28 -30.72 15.71 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 113.136 -1.847 . . . . 0.0 107.366 171.342 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.74 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 62.7 ttt180 -73.49 -37.63 65.66 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 114.478 -1.237 . . . . 0.0 109.59 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.541 ' O ' ' HB2' ' A' ' 31' ' ' LEU . 64.5 mt -63.12 -52.33 60.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.615 175.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 76.6 mt -61.11 -42.16 92.15 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 120.069 -0.652 . . . . 0.0 111.27 178.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.2 t -77.97 -39.13 43.51 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -172.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.579 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 12.8 mt-10 -107.33 -37.07 6.34 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.973 -0.691 . . . . 0.0 111.993 -176.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.541 ' HB2' ' O ' ' A' ' 27' ' ' ILE . 1.2 mp -78.13 -31.11 49.69 Favored 'General case' 0 C--N 1.323 -0.566 0 O-C-N 122.025 -0.422 . . . . 0.0 111.315 -172.034 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.11 -32.84 67.82 Favored Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.546 176.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.7 t -104.32 -19.39 14.1 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -178.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.579 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 62.2 mtt-85 -74.63 -34.39 62.77 Favored 'General case' 0 CA--C 1.517 -0.302 0 O-C-N 122.316 -0.24 . . . . 0.0 111.628 179.216 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.475 ' HB3' ' SD ' ' A' ' 12' ' ' MET . 8.7 t0 -147.76 129.78 7.53 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-O 120.994 0.426 . . . . 0.0 111.087 -175.397 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 16.9 Cg_exo -68.71 -6.0 16.81 Favored 'Trans proline' 0 CA--C 1.529 0.251 0 C-N-CA 123.363 2.708 . . . . 0.0 112.795 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.5 ' HA ' ' HG2' ' A' ' 40' ' ' MET . 51.9 mtt180 -61.69 -25.08 67.18 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.625 0.231 . . . . 0.0 111.625 176.386 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -68.13 -21.64 64.92 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 176.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 48.6 m95 -99.36 -17.13 18.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.485 -177.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.5 ' HG2' ' HA ' ' A' ' 37' ' ' ARG . 86.2 mmm -49.61 -38.62 32.52 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.317 0.579 . . . . 0.0 110.564 175.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.646 ' HB ' ' HB2' ' A' ' 5' ' ' ALA . 3.5 p -113.07 129.95 67.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.084 173.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.45 143.12 50.8 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-O 121.45 0.643 . . . . 0.0 109.714 177.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.455 ' O ' ' HD3' ' A' ' 45' ' ' PRO . 25.6 t0 -76.79 99.31 5.09 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.05 -0.977 . . . . 0.0 113.153 -160.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -96.22 99.26 5.01 Favored Pre-proline 0 C--N 1.324 -0.536 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 166.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.455 ' HD3' ' O ' ' A' ' 43' ' ' ASP . 37.6 Cg_exo -62.38 -30.32 80.48 Favored 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 122.934 2.423 . . . . 0.0 112.765 -174.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.464 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 1.1 tm? -71.18 -39.03 72.1 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.219 -0.659 . . . . 0.0 109.219 -179.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . 0.467 ' O ' ' HG2' ' A' ' 51' ' ' MET . 42.5 t90 -75.2 -38.53 60.7 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.454 176.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.604 ' HG3' ' CZ ' ' A' ' 9' ' ' PHE . 2.1 mptm? -62.83 -33.99 76.39 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.628 177.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.417 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 33.4 mttt -75.37 -38.75 59.83 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.477 176.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.464 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 32.3 mt-10 -62.37 -47.48 84.0 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.264 177.514 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.467 ' HG2' ' O ' ' A' ' 47' ' ' TRP . 13.5 ptm -73.13 -22.74 60.47 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.098 -176.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.495 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 24.0 t80 -76.97 -38.43 53.26 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.53 176.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 49' ' ' LYS . 47.2 mm-40 -67.31 -33.83 76.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.924 0.393 . . . . 0.0 110.019 176.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.2 tttt -72.32 -37.73 68.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.866 175.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -61.85 -31.75 72.04 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.52 178.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 83.1 mt -84.15 -33.28 24.29 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -178.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 72.4 p -106.26 9.16 32.13 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -175.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.479 ' O ' ' HB2' ' A' ' 59' ' ' ARG . 0.2 OUTLIER -153.09 -49.79 0.1 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.741 -0.209 . . . . 0.0 110.498 -176.759 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.479 ' HB2' ' O ' ' A' ' 58' ' ' ASN . 50.9 mtt180 . . . . . 0 C--O 1.247 0.931 0 O-C-N 124.113 0.883 . . . . 0.0 110.168 -178.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.425 ' O ' ' HG3' ' A' ' 7' ' ' LYS . 65.0 mtm . . . . . 0 CA--C 1.517 -0.289 0 CA-C-O 121.16 0.505 . . . . 0.0 109.997 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -58.49 -56.56 20.61 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.963 -175.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.605 ' HB3' ' HB ' ' A' ' 41' ' ' VAL . . . -64.67 -34.44 78.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.647 -176.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.603 ' HG3' ' HE3' ' A' ' 51' ' ' MET . 34.6 tt0 -62.99 -52.87 61.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.898 0.38 . . . . 0.0 110.025 178.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' A' ' 3' ' ' MET . 45.8 mtpt -64.33 -35.91 82.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.689 -179.269 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -61.66 -37.78 85.33 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.938 0.399 . . . . 0.0 110.185 174.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.564 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 30.3 t80 -71.43 -39.28 71.15 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.32 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.529 HG12 ' O ' ' A' ' 6' ' ' GLU . 47.5 mm -71.39 -37.7 66.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.281 0.562 . . . . 0.0 110.399 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 38.9 m -72.77 -24.37 60.94 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.193 175.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.732 ' HB2' ' HD2' ' A' ' 37' ' ' ARG . 46.7 ttp -75.18 -33.14 61.41 Favored 'General case' 0 CA--C 1.509 -0.611 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 178.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 9' ' ' PHE . 80.1 mt -68.06 -38.3 82.3 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.108 176.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 62.7 mttt -69.55 -40.38 76.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.256 0.551 . . . . 0.0 111.039 176.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -73.97 -13.32 60.86 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.823 179.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.519 ' OD1' ' HD2' ' A' ' 34' ' ' ARG . 0.9 OUTLIER -106.66 10.82 30.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.841 0.353 . . . . 0.0 110.644 177.546 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 41.9 mm-40 56.37 31.83 19.43 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.014 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.455 HG12 HD22 ' A' ' 13' ' ' LEU . 58.3 t -75.71 140.95 16.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.786 -178.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -157.94 -158.81 0.76 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.026 -0.533 . . . . 0.0 109.597 172.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.7 p -51.23 -32.25 23.52 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.1 t -85.32 25.86 0.96 Allowed 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.42 0.628 . . . . 0.0 111.88 -174.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.671 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 3.6 m95 -115.89 140.73 48.95 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.955 0.407 . . . . 0.0 110.873 178.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 84.9 p -97.08 168.49 10.42 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 173.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.422 ' CD1' HD12 ' A' ' 27' ' ' ILE . 41.7 t80 -89.04 15.75 8.19 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 122.172 0.987 . . . . 0.0 108.957 177.081 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.0 m -94.14 -42.9 8.74 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 113.842 -1.526 . . . . 0.0 107.462 170.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.671 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 19.7 ttt180 -60.58 -38.05 83.32 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 113.57 -1.65 . . . . 0.0 109.437 174.431 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.744 HG23 HD22 ' A' ' 31' ' ' LEU . 50.7 mt -61.15 -58.25 8.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.64 175.223 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 71.3 mt -60.18 -34.78 58.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.543 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.4 t -79.24 -38.85 34.61 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -174.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 26.8 mm-40 -104.05 -34.55 8.39 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 -173.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.744 HD22 HG23 ' A' ' 27' ' ' ILE . 5.1 mp -86.47 -15.06 41.33 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.434 0.635 . . . . 0.0 109.725 -176.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -83.34 -5.53 88.67 Favored Glycine 0 N--CA 1.439 -1.108 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.275 174.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 23.7 p -128.02 -45.44 1.41 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -175.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.519 ' HD2' ' OD1' ' A' ' 16' ' ' ASN . 47.1 mtt180 -53.5 -44.86 69.4 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -177.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.435 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 16.6 t70 -160.34 129.44 3.15 Favored Pre-proline 0 C--N 1.323 -0.559 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 177.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.494 ' O ' ' HG3' ' A' ' 40' ' ' MET . 16.3 Cg_exo -69.46 27.56 0.17 Allowed 'Trans proline' 0 CA--C 1.533 0.438 0 C-N-CA 123.577 2.852 . . . . 0.0 114.851 -171.241 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.732 ' HD2' ' HB2' ' A' ' 12' ' ' MET . 87.1 mtt180 -65.5 -28.42 69.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.122 0.487 . . . . 0.0 110.142 176.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.418 ' CE1' ' HD2' ' A' ' 48' ' ' LYS . 49.9 t80 -69.26 -20.57 63.93 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.461 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 46.4 m95 -103.63 -28.64 11.59 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.524 -175.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.71 ' HE1' ' HA ' ' A' ' 37' ' ' ARG . 47.9 mtm -55.56 -41.5 73.37 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.178 0.514 . . . . 0.0 110.207 178.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.605 ' HB ' ' HB3' ' A' ' 5' ' ' ALA . 3.4 p -89.91 123.08 41.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 169.5 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -58.86 143.8 46.41 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-O 121.68 0.752 . . . . 0.0 110.671 -176.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -75.37 98.29 3.82 Favored 'General case' 0 N--CA 1.436 -1.129 0 CA-C-N 114.667 -1.151 . . . . 0.0 113.594 -163.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -106.0 95.97 11.99 Favored Pre-proline 0 C--N 1.317 -0.818 0 N-CA-C 106.868 -1.531 . . . . 0.0 106.868 158.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.845 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 25.9 Cg_exo -62.68 -37.37 57.45 Favored 'Trans proline' 0 N--CA 1.449 -1.147 0 C-N-CA 121.997 1.798 . . . . 0.0 111.997 -173.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.485 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -61.4 -38.75 88.22 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.228 -179.822 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 48.4 t90 -69.25 -38.34 78.41 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-O 120.875 0.369 . . . . 0.0 110.038 173.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.418 ' HD2' ' CE1' ' A' ' 38' ' ' TYR . 23.4 mmtp -60.6 -33.36 72.62 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.363 177.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.845 ' HG3' ' O ' ' A' ' 45' ' ' PRO . 31.7 mtpt -82.54 -38.44 23.74 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.236 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 42.9 mt-10 -61.84 -39.02 90.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.285 0.564 . . . . 0.0 111.271 176.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.603 ' HE3' ' HG3' ' A' ' 6' ' ' GLU . 17.6 ptm -78.79 -26.96 44.45 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-O 121.217 0.532 . . . . 0.0 109.767 -178.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.505 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 33.7 t80 -71.36 -39.28 71.39 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.155 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -74.39 -22.16 59.31 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.546 0.689 . . . . 0.0 109.464 177.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.7 tptm -71.09 -37.51 72.42 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.49 172.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -68.16 -25.84 65.46 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.628 178.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 58.7 mt -86.43 -32.53 20.82 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.309 178.602 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -89.91 -49.21 6.74 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.131 0.491 . . . . 0.0 110.961 -177.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -86.36 -56.29 3.51 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.74 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 . . . . . 0 C--O 1.247 0.935 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.575 -179.522 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 29.6 ttp . . . . . 0 N--CA 1.45 -0.448 0 CA-C-O 121.12 0.486 . . . . 0.0 110.081 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -66.37 -44.51 82.93 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.846 178.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.424 ' HB2' ' HB ' ' A' ' 41' ' ' VAL . . . -60.03 -42.15 93.76 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.582 176.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -57.97 -46.71 84.7 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.798 177.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.465 ' HE2' ' HA ' ' A' ' 7' ' ' LYS . 5.8 mmpt? -48.72 -57.7 5.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.341 179.298 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.474 ' O ' ' HG2' ' A' ' 12' ' ' MET . 28.2 mt-10 -73.4 -29.85 62.87 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.53 -178.337 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.586 ' HE2' ' HE2' ' A' ' 48' ' ' LYS . 0.4 OUTLIER -58.98 -40.62 85.36 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 177.81 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.53 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 33.4 mm -71.56 -37.08 62.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.339 0.59 . . . . 0.0 110.354 177.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 23.1 m -64.2 -40.8 96.82 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.301 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.474 ' HG2' ' O ' ' A' ' 8' ' ' GLU . 16.4 ptm -75.68 -23.63 56.23 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -177.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 9' ' ' PHE . 85.2 mt -68.77 -39.89 79.98 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.628 174.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.53 ' HD3' ' O ' ' A' ' 10' ' ' ILE . 0.1 OUTLIER -71.56 -39.78 70.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.394 0.616 . . . . 0.0 110.422 177.126 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -75.45 -14.17 60.42 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.597 -0.729 . . . . 0.0 112.546 -175.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.433 HD21 ' HA ' ' A' ' 16' ' ' ASN . 0.8 OUTLIER -107.87 20.18 19.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.834 0.35 . . . . 0.0 110.928 176.274 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 59.79 31.64 20.91 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.339 175.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.501 HG22 ' CE2' ' A' ' 22' ' ' TRP . 51.6 t -78.15 128.85 38.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.029 0.442 . . . . 0.0 111.264 -177.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -150.34 -157.46 0.82 Allowed 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 171.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.8 m -65.46 -9.02 22.07 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.5 p -79.06 -16.92 56.11 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 121.019 0.438 . . . . 0.0 111.199 176.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.597 ' CE2' ' HD3' ' A' ' 26' ' ' ARG . 7.2 m95 -86.86 119.69 27.35 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.281 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.413 ' C ' ' H ' ' A' ' 25' ' ' SER . 5.5 m -83.93 165.49 18.64 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 168.574 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.552 ' CD1' HD13 ' A' ' 27' ' ' ILE . 29.3 t80 -82.46 16.48 2.08 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 122.454 1.121 . . . . 0.0 109.577 -175.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.413 ' H ' ' C ' ' A' ' 23' ' ' SER . 48.1 t -91.4 -31.59 15.97 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-N 113.673 -1.603 . . . . 0.0 107.452 172.165 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.597 ' HD3' ' CE2' ' A' ' 22' ' ' TRP . 28.7 ttt180 -75.05 -33.32 61.71 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.846 179.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.552 HD13 ' CD1' ' A' ' 24' ' ' PHE . 54.2 mt -66.15 -42.3 90.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.175 176.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.6 mt -74.58 -43.36 48.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 119.561 -0.855 . . . . 0.0 111.808 175.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.2 t -82.4 -38.87 23.47 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -169.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.799 ' O ' ' HB2' ' A' ' 34' ' ' ARG . 28.9 mm-40 -103.89 -35.77 8.03 Favored 'General case' 0 C--O 1.212 -0.902 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.319 -176.701 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.533 HD21 HG22 ' A' ' 27' ' ' ILE . 8.9 tp -87.57 -36.27 17.64 Favored 'General case' 0 C--N 1.315 -0.91 0 O-C-N 123.569 0.543 . . . . 0.0 111.153 -167.049 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.48 -49.35 79.55 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.297 177.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 68.8 p -83.41 -10.08 58.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.048 0.451 . . . . 0.0 111.64 -177.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.799 ' HB2' ' O ' ' A' ' 30' ' ' GLU . 53.2 ttm-85 -83.31 -45.16 14.1 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.051 -177.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.423 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 8.0 t70 -138.09 128.23 15.24 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.583 -176.36 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 20.6 Cg_exo -66.87 -13.06 38.48 Favored 'Trans proline' 0 N--CA 1.465 -0.168 0 C-N-CA 123.517 2.811 . . . . 0.0 113.269 -178.058 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.487 ' HA ' ' HB2' ' A' ' 40' ' ' MET . 79.7 mtm180 -64.54 -19.45 65.63 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -70.3 -24.44 63.02 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 121.082 0.467 . . . . 0.0 109.881 175.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 53.9 m95 -101.6 -18.86 15.71 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.768 -178.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.487 ' HB2' ' HA ' ' A' ' 37' ' ' ARG . 18.3 ttp -52.55 -46.51 66.82 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 121.407 0.622 . . . . 0.0 109.778 175.117 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.424 ' HB ' ' HB2' ' A' ' 5' ' ' ALA . 7.6 p -89.19 133.97 29.83 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 168.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.4 143.01 50.95 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-O 121.334 0.588 . . . . 0.0 109.829 177.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -82.53 97.52 8.48 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.892 -165.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -103.26 101.41 22.29 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 114.691 -1.14 . . . . 0.0 108.45 170.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -59.23 -25.56 78.62 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.872 2.382 . . . . 0.0 112.574 -176.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -75.47 -39.3 58.87 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 47.1 t90 -75.52 -38.38 59.44 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.567 176.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.586 ' HE2' ' HE2' ' A' ' 9' ' ' PHE . 2.8 mptm? -62.66 -33.23 74.62 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 176.309 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.409 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 24.9 mttm -75.73 -41.43 53.39 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 120.975 -0.29 . . . . 0.0 110.833 176.242 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -61.55 -48.15 82.32 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.226 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.435 ' HB2' ' HE1' ' A' ' 51' ' ' MET . 3.5 ppp? -75.28 -27.69 59.49 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.787 -174.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.607 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 35.3 t80 -74.59 -38.97 62.47 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.678 178.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 49' ' ' LYS . 45.2 mt-10 -73.0 -23.05 60.59 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 176.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 31.8 tptt -73.22 -38.45 66.06 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.522 0.677 . . . . 0.0 109.456 172.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.7 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 61.7 t80 -71.75 -23.06 61.54 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.666 -177.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 56.3 mt -89.5 -33.8 16.64 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.961 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -95.72 -53.32 3.75 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.887 0.375 . . . . 0.0 110.805 -176.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -75.11 -53.38 8.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.018 178.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.7 ' HG2' ' O ' ' A' ' 55' ' ' TYR . 77.1 mtt180 . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.438 -178.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 83.1 mtp . . . . . 0 C--O 1.236 0.389 0 CA-C-O 121.025 0.44 . . . . 0.0 109.952 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.582 ' O ' ' HG3' ' A' ' 8' ' ' GLU . 23.1 mt-10 -64.1 -40.59 96.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.941 176.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.644 ' HB3' ' HB ' ' A' ' 41' ' ' VAL . . . -63.22 -35.69 81.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.685 -178.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.529 ' O ' HG12 ' A' ' 10' ' ' ILE . 32.6 tt0 -58.8 -51.26 70.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.352 0.596 . . . . 0.0 109.849 174.271 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.432 ' HE2' ' HB3' ' A' ' 7' ' ' LYS . 51.1 mtpt -63.03 -39.33 94.44 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.012 -179.099 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.582 ' HG3' ' O ' ' A' ' 4' ' ' GLU . 42.5 mt-10 -63.36 -40.23 96.69 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 120.904 0.383 . . . . 0.0 110.066 176.076 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.449 ' HA ' ' HG2' ' A' ' 12' ' ' MET . 48.2 t80 -60.75 -37.83 83.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.104 176.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.606 ' O ' ' HD2' ' A' ' 14' ' ' LYS . 41.0 mm -71.81 -37.08 60.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.387 178.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.6 m -66.67 -40.55 88.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.486 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.492 ' SD ' ' HB3' ' A' ' 37' ' ' ARG . 24.3 ptm -73.41 -22.24 60.28 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.477 HD23 ' HG3' ' A' ' 12' ' ' MET . 0.1 OUTLIER -70.45 -37.83 74.39 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.335 176.563 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.606 ' HD2' ' O ' ' A' ' 10' ' ' ILE . 3.8 mptt -68.16 -37.71 81.3 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.321 0.582 . . . . 0.0 109.847 173.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -66.21 -36.78 83.94 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.95 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -88.95 10.12 22.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.056 -179.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 61.71 31.79 18.48 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.37 176.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.45 HG13 HD12 ' A' ' 13' ' ' LEU . 40.2 t -75.75 139.47 18.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.682 0.277 . . . . 0.0 110.871 -177.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.458 ' OD1' HG22 ' A' ' 21' ' ' THR . 4.5 p-10 -156.4 -161.02 1.05 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.023 175.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.661 ' HA ' HD23 ' A' ' 56' ' ' LEU . 69.3 m -60.39 -30.52 69.64 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -175.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.458 HG22 ' OD1' ' A' ' 19' ' ' ASP . 13.2 t -81.19 11.31 4.34 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.991 0.424 . . . . 0.0 111.935 -175.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.512 ' CZ3' HD13 ' A' ' 31' ' ' LEU . 5.3 m95 -96.67 138.87 33.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.201 0.525 . . . . 0.0 111.56 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -97.03 154.85 17.07 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 171.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.435 ' HD1' HD12 ' A' ' 27' ' ' ILE . 67.2 t80 -86.19 14.96 5.62 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 122.196 0.998 . . . . 0.0 110.358 -175.303 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.0 m -93.31 -33.31 13.96 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 114.315 -1.311 . . . . 0.0 107.581 168.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -70.13 -36.91 75.12 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 114.05 -1.432 . . . . 0.0 109.512 176.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.715 HG23 HD21 ' A' ' 31' ' ' LEU . 28.4 mt -61.1 -54.95 28.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.244 173.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 68.4 mt -61.55 -37.1 77.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 120.022 -0.671 . . . . 0.0 111.459 179.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.8 t -79.29 -40.94 29.21 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -173.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -99.86 -34.14 10.26 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.851 -175.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.715 HD21 HG23 ' A' ' 27' ' ' ILE . 4.2 mp -84.47 -23.51 29.86 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 -176.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -76.45 -13.34 83.51 Favored Glycine 0 N--CA 1.444 -0.814 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.588 174.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.4 p -114.58 -45.94 2.98 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 -176.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 90.1 mtt-85 -56.38 -44.69 80.46 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -177.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.421 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 9.7 t70 -145.91 130.64 8.93 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-O 120.829 0.347 . . . . 0.0 111.067 -173.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 24.5 Cg_exo -64.66 -4.99 9.39 Favored 'Trans proline' 0 CA--C 1.531 0.375 0 C-N-CA 123.6 2.866 . . . . 0.0 113.744 -178.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.492 ' HB3' ' SD ' ' A' ' 12' ' ' MET . 13.3 mtm180 -55.28 -28.64 54.82 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 176.074 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 70.9 t80 -68.64 -20.21 64.46 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.001 0.429 . . . . 0.0 110.133 178.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 58.7 m95 -107.05 -21.95 12.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.241 -177.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 85.0 mtp -58.17 -42.48 86.13 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.442 0.639 . . . . 0.0 109.341 174.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.644 ' HB ' ' HB3' ' A' ' 5' ' ' ALA . 6.7 p -86.21 132.01 33.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.328 -0.851 . . . . 0.0 108.842 169.403 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.19 143.58 48.54 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-O 121.482 0.658 . . . . 0.0 110.282 179.176 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -94.03 97.71 10.51 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.385 -166.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -105.88 97.83 16.39 Favored Pre-proline 0 N--CA 1.442 -0.862 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 163.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.591 ' O ' ' HB3' ' A' ' 49' ' ' LYS . 24.2 Cg_exo -63.1 -22.37 73.18 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.65 2.234 . . . . 0.0 112.474 -171.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -74.78 -39.27 61.84 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 177.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . 0.415 ' O ' ' HG2' ' A' ' 51' ' ' MET . 45.3 t90 -72.93 -38.36 66.86 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 173.378 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.55 ' HB2' ' HA ' ' A' ' 45' ' ' PRO . 24.8 mmtp -59.78 -33.66 71.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.185 177.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.591 ' HB3' ' O ' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -87.07 -32.82 19.75 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.509 -178.657 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -67.14 -39.55 86.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.048 0.451 . . . . 0.0 111.131 176.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.42 ' HE1' ' HG3' ' A' ' 6' ' ' GLU . 16.9 ptm -74.79 -26.39 59.71 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.653 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 32.4 t80 -69.37 -36.06 76.45 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.209 173.007 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 49' ' ' LYS . 38.0 mm-40 -65.13 -31.95 73.4 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.248 0.547 . . . . 0.0 109.651 175.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -72.99 -38.6 66.59 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.99 177.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.401 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 86.1 t80 -70.02 -20.99 63.24 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.084 -177.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.661 HD23 ' HA ' ' A' ' 20' ' ' SER . 87.1 mt -81.75 -33.24 31.12 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.258 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 37.0 p -100.32 -46.45 5.26 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.9 0.381 . . . . 0.0 111.632 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.417 ' O ' ' HB2' ' A' ' 59' ' ' ARG . 6.8 t30 -89.59 -47.65 7.82 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.705 -176.347 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 58' ' ' ASN . 76.3 mtt180 . . . . . 0 C--O 1.251 1.151 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.231 -173.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 78.5 mtp . . . . . 0 N--CA 1.456 -0.172 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -63.03 -30.82 71.9 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.305 0.574 . . . . 0.0 110.041 177.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.576 ' O ' ' HB2' ' A' ' 9' ' ' PHE . . . -56.18 -56.45 20.72 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.691 177.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.424 ' O ' HG12 ' A' ' 10' ' ' ILE . 28.9 tt0 -71.06 -47.12 60.22 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.972 -178.251 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.622 ' O ' ' HE2' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -42.3 -64.1 0.65 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.772 -1.104 . . . . 0.0 111.305 176.45 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.495 ' HB3' ' CD ' ' A' ' 37' ' ' ARG . 56.0 mm-40 -78.41 -16.71 57.32 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.75 -0.38 . . . . 0.0 112.009 -175.054 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.576 ' HB2' ' O ' ' A' ' 5' ' ' ALA . 21.3 t80 -69.5 -40.04 77.25 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 175.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.424 HG12 ' O ' ' A' ' 6' ' ' GLU . 46.0 mm -74.41 -36.31 41.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 121.551 0.691 . . . . 0.0 109.824 178.011 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 19.9 m -66.92 -33.29 75.27 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.607 178.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.505 ' HE3' ' HA ' ' A' ' 9' ' ' PHE . 18.1 ttp -76.57 -32.4 58.12 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.107 179.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.457 HD13 HG11 ' A' ' 18' ' ' VAL . 0.1 OUTLIER -68.43 -38.57 81.3 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.104 179.105 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 14.3 mtpt -68.18 -40.96 82.1 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.012 0.434 . . . . 0.0 110.845 175.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.425 ' CD ' HH22 ' A' ' 37' ' ' ARG . 29.8 mt-10 -67.05 -18.56 65.4 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.078 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -105.05 16.56 25.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.785 178.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 56.28 32.42 20.36 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.527 -0.761 . . . . 0.0 112.682 176.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.457 HG11 HD13 ' A' ' 13' ' ' LEU . 58.1 t -76.41 119.41 24.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.008 0.433 . . . . 0.0 111.288 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -128.58 -156.0 0.73 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.507 172.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.1 p -68.91 -8.72 46.81 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.034 0.445 . . . . 0.0 111.365 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.4 p -79.77 9.66 4.94 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.781 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.671 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 11.7 m95 -117.76 146.2 43.96 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.15 0.5 . . . . 0.0 111.876 -175.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.9 m -110.17 164.93 12.16 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 165.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.672 ' CE1' ' HB3' ' A' ' 48' ' ' LYS . 88.5 t80 -82.99 16.27 2.39 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 122.308 1.051 . . . . 0.0 110.891 -171.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.5 m -92.16 -32.55 15.06 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 113.861 -1.518 . . . . 0.0 107.947 171.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.671 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 42.5 ttt180 -71.07 -35.46 71.9 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.408 -1.269 . . . . 0.0 109.398 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.54 ' O ' ' HB2' ' A' ' 31' ' ' LEU . 54.9 mt -64.62 -54.45 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.867 175.131 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.1 mt -62.23 -40.19 86.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 C-N-CA 119.691 -0.804 . . . . 0.0 111.348 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.6 t -76.96 -39.27 51.22 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -173.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -112.65 -33.28 6.18 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -173.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.54 ' HB2' ' O ' ' A' ' 27' ' ' ILE . 1.6 mp -78.28 -30.27 48.41 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 122.04 -0.413 . . . . 0.0 110.859 -177.089 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.66 -18.61 64.04 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.731 -0.747 . . . . 0.0 111.969 175.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.0 p -112.06 -27.69 8.29 Favored 'General case' 0 C--O 1.234 0.254 0 O-C-N 122.381 -0.481 . . . . 0.0 111.996 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.9 mtm180 -74.67 -30.48 61.6 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -178.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.443 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 7.9 t70 -151.48 128.97 5.67 Favored Pre-proline 0 C--N 1.329 -0.3 0 C-N-CA 120.199 -0.6 . . . . 0.0 111.185 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 16.3 Cg_exo -69.85 -5.34 16.02 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 123.466 2.777 . . . . 0.0 113.825 -178.208 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.495 ' CD ' ' HB3' ' A' ' 8' ' ' GLU . 57.7 mtm180 -60.62 -22.28 63.61 Favored 'General case' 0 C--N 1.333 -0.123 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 176.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 69.1 t80 -68.3 -20.62 64.77 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.899 0.381 . . . . 0.0 110.007 176.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 56.7 m95 -105.25 -17.88 14.31 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.4 -176.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 90.5 mmm -57.65 -37.77 73.94 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.324 0.583 . . . . 0.0 109.87 175.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 6.3 p -96.62 141.3 15.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.455 -0.793 . . . . 0.0 108.886 169.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -59.92 143.7 50.85 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-O 121.616 0.722 . . . . 0.0 109.735 175.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.4 ' HA ' ' HZ1' ' A' ' 48' ' ' LYS . 25.3 t0 -81.56 97.25 7.75 Favored 'General case' 0 C--N 1.301 -1.509 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.089 -171.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -102.05 98.25 9.81 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 170.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -61.41 -30.57 87.31 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.66 2.24 . . . . 0.0 112.699 -173.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.46 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 0.6 OUTLIER -72.53 -40.0 67.1 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.742 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . 0.491 ' O ' ' HG2' ' A' ' 51' ' ' MET . 41.8 t90 -73.79 -38.04 64.76 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-N 116.778 -0.192 . . . . 0.0 110.567 176.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.672 ' HB3' ' CE1' ' A' ' 24' ' ' PHE . 2.5 mptm? -63.37 -33.37 75.38 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.289 177.283 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.406 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 23.7 mttm -73.76 -40.6 63.37 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 120.927 0.394 . . . . 0.0 110.19 176.018 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 42.8 mt-10 -63.23 -44.64 94.68 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.067 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.491 ' HG2' ' O ' ' A' ' 47' ' ' TRP . 13.5 ptm -76.7 -21.61 55.08 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.215 -176.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.4 ' CZ ' HD11 ' A' ' 56' ' ' LEU . 22.5 t80 -76.35 -37.95 56.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.167 176.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 49' ' ' LYS . 37.7 mt-10 -67.56 -30.95 70.72 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 175.402 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.4 tttt -71.85 -37.69 70.2 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.392 175.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -66.85 -23.72 66.06 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.941 0.4 . . . . 0.0 111.039 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.4 HD11 ' CZ ' ' A' ' 52' ' ' PHE . 67.4 mt -98.6 -33.46 10.96 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.6 t -89.48 -23.32 22.12 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.05 0.453 . . . . 0.0 111.233 -177.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -126.41 -53.06 1.48 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.665 -178.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 . . . . . 0 C--O 1.251 1.164 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.585 -179.688 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 12.6 tpt . . . . . 0 N--CA 1.448 -0.549 0 CA-C-O 121.112 0.482 . . . . 0.0 109.978 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -65.11 -47.7 76.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.726 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.584 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -59.28 -43.36 92.55 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.58 -1.191 . . . . 0.0 111.265 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.577 ' HG3' ' HE2' ' A' ' 51' ' ' MET . 32.1 tt0 -63.78 -49.55 72.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.014 0.435 . . . . 0.0 110.641 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.428 ' HE2' ' HB3' ' A' ' 7' ' ' LYS . 15.1 ttpt -49.73 -51.45 38.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.362 -0.836 . . . . 0.0 112.122 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -71.32 -33.55 69.75 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.044 -179.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.622 ' O ' HD21 ' A' ' 13' ' ' LEU . 36.2 t80 -61.68 -38.17 86.83 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.133 0.492 . . . . 0.0 110.113 177.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.499 HG12 ' O ' ' A' ' 6' ' ' GLU . 44.4 mm -71.97 -35.91 55.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.349 0.595 . . . . 0.0 110.145 177.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 48.4 m -67.94 -41.5 82.45 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.642 -179.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.556 ' SD ' ' HA ' ' A' ' 9' ' ' PHE . 21.7 ptm -70.44 -28.99 65.46 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -179.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.622 HD21 ' O ' ' A' ' 9' ' ' PHE . 1.8 mm? -68.46 -37.4 80.15 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.022 177.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.6 mttt -69.73 -38.51 76.91 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.925 175.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -68.28 -27.5 66.38 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.768 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.572 ' ND2' ' HG ' ' A' ' 31' ' ' LEU . 94.3 m-20 -90.82 9.5 29.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.216 -179.151 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 57.48 31.35 20.11 Favored 'General case' 0 CA--C 1.526 0.046 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.267 176.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.576 HG21 HD13 ' A' ' 13' ' ' LEU . 66.3 t -74.1 129.45 36.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.605 -175.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -120.57 -162.58 0.95 Allowed 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 170.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.6 p -77.24 -6.45 53.11 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.899 0.38 . . . . 0.0 111.693 -178.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.5 p -81.8 -13.48 57.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.904 0.383 . . . . 0.0 111.459 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.511 ' CZ3' HD13 ' A' ' 31' ' ' LEU . 6.1 m95 -74.2 136.02 42.78 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.704 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.8 t -90.25 156.66 18.14 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 169.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.52 ' CZ ' ' HB3' ' A' ' 48' ' ' LYS . 42.1 t80 -83.49 16.68 2.48 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 122.123 0.963 . . . . 0.0 109.513 -177.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 27.4 t -93.1 -41.7 9.8 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.135 -1.393 . . . . 0.0 107.611 171.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.508 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 54.2 ttt180 -65.25 -34.29 78.02 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.092 -1.413 . . . . 0.0 109.506 176.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.707 HG22 HD21 ' A' ' 31' ' ' LEU . 59.6 mt -62.99 -56.76 15.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.153 174.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 24' ' ' PHE . 40.1 mm -59.59 -38.46 75.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 120.583 -0.447 . . . . 0.0 111.644 179.125 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.8 t -82.16 -38.81 24.13 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -171.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.535 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 8.3 mm-40 -100.55 -35.26 9.58 Favored 'General case' 0 C--O 1.217 -0.657 0 C-N-CA 120.462 -0.495 . . . . 0.0 111.429 -176.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.707 HD21 HG22 ' A' ' 27' ' ' ILE . 4.6 mp -82.19 -20.14 38.42 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -177.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -79.42 -6.79 88.85 Favored Glycine 0 N--CA 1.44 -1.056 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.571 173.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 38.8 p -125.84 -29.16 3.14 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -176.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.535 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 41.5 mtt180 -56.85 -52.14 66.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.635 0.255 . . . . 0.0 111.085 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.459 ' OD1' ' HB2' ' A' ' 37' ' ' ARG . 1.8 p30 -154.93 148.96 19.04 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.297 178.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.43 ' O ' ' HG2' ' A' ' 40' ' ' MET . 20.5 Cg_exo -66.74 4.5 1.06 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.682 2.922 . . . . 0.0 114.295 -174.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.459 ' HB2' ' OD1' ' A' ' 35' ' ' ASP . 54.3 mtm180 -59.21 -34.92 72.73 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 117.77 0.259 . . . . 0.0 111.599 178.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -69.2 -17.26 63.77 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 120.899 0.38 . . . . 0.0 110.173 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -102.2 -19.25 15.16 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.725 -179.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.43 ' HG2' ' O ' ' A' ' 36' ' ' PRO . 95.7 mmm -64.11 -51.88 61.86 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 172.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.584 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 2.6 p -86.58 114.16 25.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.144 -0.934 . . . . 0.0 109.066 171.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -58.4 145.6 37.8 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 122.184 0.993 . . . . 0.0 111.709 -172.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.724 ' HA ' ' HZ1' ' A' ' 48' ' ' LYS . 10.7 p-10 -78.67 96.9 5.65 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 114.081 -1.418 . . . . 0.0 112.071 -170.353 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -104.14 99.59 17.64 Favored Pre-proline 0 C--N 1.32 -0.704 0 N-CA-C 107.551 -1.278 . . . . 0.0 107.551 165.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -62.47 -24.73 75.59 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 122.354 2.036 . . . . 0.0 113.098 -172.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.423 ' HA ' HD23 ' A' ' 46' ' ' LEU . 0.6 OUTLIER -80.62 -39.53 27.3 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 -179.19 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . 0.499 ' O ' ' HG2' ' A' ' 51' ' ' MET . 44.4 t90 -74.76 -37.83 62.37 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.403 175.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.724 ' HZ1' ' HA ' ' A' ' 43' ' ' ASP . 1.2 mptm? -61.99 -32.27 72.72 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.256 -0.275 . . . . 0.0 110.256 177.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 36.3 mttt -77.62 -39.4 45.51 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 120.841 0.353 . . . . 0.0 110.711 175.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -64.11 -40.08 95.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.037 0.446 . . . . 0.0 111.266 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.577 ' HE2' ' HG3' ' A' ' 6' ' ' GLU . 12.7 ptm -79.13 -21.33 46.7 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.544 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 22.3 t80 -69.9 -37.15 75.91 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.514 -0.551 . . . . 0.0 109.514 173.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -67.01 -30.91 71.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.133 173.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.437 ' HE2' ' OD1' ' A' ' 58' ' ' ASN . 13.7 tptm -71.72 -38.32 70.51 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.253 176.018 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.432 ' O ' ' HA ' ' A' ' 59' ' ' ARG . 32.4 t80 -65.79 -34.13 77.45 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.602 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 76.0 mt -79.24 -32.04 43.73 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 120.943 -0.303 . . . . 0.0 111.511 -179.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.1 p -87.08 -64.0 1.22 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.888 0.375 . . . . 0.0 111.692 178.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.51 ' O ' ' HB2' ' A' ' 59' ' ' ARG . 0.2 OUTLIER -70.45 -47.92 58.36 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.275 -178.214 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.51 ' HB2' ' O ' ' A' ' 58' ' ' ASN . 21.6 mmt180 . . . . . 0 C--O 1.246 0.887 0 O-C-N 123.988 0.805 . . . . 0.0 110.723 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 38.4 ttp . . . . . 0 N--CA 1.448 -0.547 0 CA-C-O 121.308 0.575 . . . . 0.0 109.515 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -62.18 -46.1 90.46 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.087 177.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.571 ' CB ' ' HB ' ' A' ' 41' ' ' VAL . . . -63.97 -29.68 70.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.979 -1.009 . . . . 0.0 111.315 -179.434 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.49 ' O ' HG12 ' A' ' 10' ' ' ILE . 12.9 tt0 -60.81 -56.62 19.09 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.417 0.627 . . . . 0.0 110.3 177.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.507 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -58.32 -42.57 87.05 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.806 -1.088 . . . . 0.0 111.374 -178.545 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -62.14 -38.59 89.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.203 0.525 . . . . 0.0 110.478 176.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.531 ' HA ' ' HE2' ' A' ' 12' ' ' MET . 14.6 t80 -64.84 -39.58 93.8 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.084 178.502 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.49 HG12 ' O ' ' A' ' 6' ' ' GLU . 48.1 mm -70.75 -37.77 70.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.138 0.494 . . . . 0.0 110.542 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 35.1 m -68.65 -31.71 71.04 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.332 176.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.531 ' HE2' ' HA ' ' A' ' 9' ' ' PHE . 37.8 ttp -71.78 -33.29 68.47 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 177.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.639 HD23 HD22 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -71.02 -39.84 72.13 Favored 'General case' 0 N--CA 1.439 -0.977 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.935 178.903 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.0 mtpp -64.67 -35.42 80.98 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.178 0.513 . . . . 0.0 110.611 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.487 ' CD ' HH22 ' A' ' 37' ' ' ARG . 29.7 mt-10 -70.63 -22.84 62.48 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.018 178.466 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -101.98 7.19 41.43 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.415 176.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 6.8 mm100 56.76 31.11 18.86 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 173.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.613 HG12 HD11 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -67.32 143.89 15.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.658 0.742 . . . . 0.0 111.274 -179.969 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.55 ' CG ' ' H ' ' A' ' 20' ' ' SER . 0.0 OUTLIER -148.25 -174.22 4.52 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.848 179.012 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.55 ' H ' ' CG ' ' A' ' 19' ' ' ASP . 4.3 p -58.02 -23.15 53.01 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 120.857 0.36 . . . . 0.0 111.754 -175.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.2 p -77.45 -1.4 30.11 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.706 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 4.3 m95 -84.94 144.96 28.0 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.927 0.394 . . . . 0.0 110.398 174.435 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.8 p -102.88 165.78 10.84 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 172.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.499 ' CD1' HD12 ' A' ' 27' ' ' ILE . 30.2 t80 -87.21 15.87 5.8 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 122.48 1.133 . . . . 0.0 108.553 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.2 t -91.43 -38.78 12.36 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 106.633 -1.618 . . . . 0.0 106.633 168.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.706 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 36.9 ttt180 -67.44 -34.5 77.33 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.595 176.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.722 HG21 HD23 ' A' ' 31' ' ' LEU . 52.0 mt -66.61 -42.08 89.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.644 178.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.1 mt -78.64 -33.34 16.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 C-N-CA 119.284 -0.966 . . . . 0.0 111.866 176.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.7 p -87.64 -40.58 14.06 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -171.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.643 ' O ' ' HD3' ' A' ' 34' ' ' ARG . 26.2 mm-40 -106.82 -36.56 6.63 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 121.279 0.561 . . . . 0.0 110.219 -176.152 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.722 HD23 HG21 ' A' ' 27' ' ' ILE . 11.5 tp -80.22 -36.17 35.19 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.322 -170.241 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.56 -22.34 76.55 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.087 175.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 35.5 p -101.57 -28.29 12.61 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 122.425 -0.456 . . . . 0.0 111.731 -178.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.643 ' HD3' ' O ' ' A' ' 30' ' ' GLU . 0.5 OUTLIER -63.34 -48.57 77.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.319 179.175 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.48 ' HB3' ' SD ' ' A' ' 12' ' ' MET . 4.8 t70 -139.04 133.92 16.58 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-O 121.056 0.455 . . . . 0.0 111.722 -170.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 17.1 Cg_exo -68.4 -11.81 33.05 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 123.694 2.93 . . . . 0.0 113.158 -179.078 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.487 HH22 ' CD ' ' A' ' 15' ' ' GLU . 72.2 mtm180 -62.16 -20.95 64.65 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 177.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -68.32 -21.71 64.74 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.967 0.413 . . . . 0.0 110.165 176.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.419 ' HD1' ' HA ' ' A' ' 36' ' ' PRO . 60.6 m95 -101.86 -17.74 16.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.683 -174.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.462 ' HG2' ' HA ' ' A' ' 37' ' ' ARG . 96.7 mmm -55.49 -37.16 67.46 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.234 0.54 . . . . 0.0 110.371 178.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.571 ' HB ' ' CB ' ' A' ' 5' ' ' ALA . 6.8 p -99.01 134.4 38.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 171.031 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -59.75 142.34 53.43 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-O 121.486 0.66 . . . . 0.0 109.875 177.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -78.8 98.83 6.45 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.008 -0.997 . . . . 0.0 112.547 -163.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -103.65 101.12 22.18 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 114.817 -1.083 . . . . 0.0 108.449 169.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -63.0 -26.61 73.94 Favored 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.855 2.37 . . . . 0.0 112.53 -175.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.536 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 1.1 tm? -75.75 -39.05 57.8 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . 0.489 ' O ' ' HG2' ' A' ' 51' ' ' MET . 45.4 t90 -74.53 -37.06 63.16 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.691 176.246 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.528 ' HG3' ' CZ ' ' A' ' 9' ' ' PHE . 2.3 mptm? -62.07 -32.46 73.0 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.593 -0.443 . . . . 0.0 109.978 175.452 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.536 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 26.9 mttm -72.69 -40.86 65.9 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 120.916 0.388 . . . . 0.0 110.31 174.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.536 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 26.5 mt-10 -66.15 -41.88 89.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.309 -178.303 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.489 ' HG2' ' O ' ' A' ' 47' ' ' TRP . 12.5 ptm -76.35 -22.05 55.36 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.86 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.493 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 28.2 t80 -75.26 -37.61 60.87 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.134 -0.484 . . . . 0.0 109.721 175.08 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.536 ' HG2' ' O ' ' A' ' 49' ' ' LYS . 79.0 mm-40 -66.35 -29.1 69.21 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 121.199 0.524 . . . . 0.0 109.634 174.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -72.53 -38.43 68.02 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.979 174.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.552 ' HE2' HG23 ' A' ' 18' ' ' VAL . 53.6 t80 -70.72 -23.08 62.38 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.621 -178.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 60.7 mt -93.54 -33.25 13.82 Favored 'General case' 0 N--CA 1.441 -0.896 0 C-N-CA 120.646 -0.422 . . . . 0.0 111.795 179.348 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 45.4 t -87.63 -32.44 19.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.8 0.333 . . . . 0.0 111.103 -178.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -109.45 -58.61 2.02 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.326 -0.397 . . . . 0.0 109.997 -178.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.8 ttm180 . . . . . 0 C--O 1.251 1.171 0 O-C-N 124.254 0.971 . . . . 0.0 110.256 -178.333 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 69.3 mtm . . . . . 0 CA--C 1.52 -0.176 0 CA-C-O 121.23 0.538 . . . . 0.0 109.737 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -65.26 -50.85 64.21 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.952 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -61.67 -29.76 70.29 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.935 -178.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -63.14 -54.12 42.7 Favored 'General case' 0 CA--C 1.509 -0.596 0 CA-C-O 121.354 0.597 . . . . 0.0 110.0 177.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.4 ' HA ' ' HD3' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -54.87 -45.64 74.64 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.668 -1.151 . . . . 0.0 111.815 -179.263 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.536 ' O ' ' HG2' ' A' ' 12' ' ' MET . 53.2 mm-40 -68.13 -35.41 78.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.586 0.232 . . . . 0.0 111.228 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.566 ' CZ ' ' HG3' ' A' ' 48' ' ' LYS . 12.6 t80 -64.22 -38.46 91.11 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.759 177.316 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.653 HG12 ' HE2' ' A' ' 51' ' ' MET . 24.4 mm -65.53 -37.44 80.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.572 0.701 . . . . 0.0 109.82 173.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.644 ' HA ' ' CE ' ' A' ' 14' ' ' LYS . 32.7 m -69.17 -41.39 77.29 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.546 -178.138 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.602 ' HE1' ' HB2' ' A' ' 38' ' ' TYR . 15.8 ptm -73.2 -33.52 65.43 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 -179.548 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.483 HD11 HG23 ' A' ' 18' ' ' VAL . 1.7 mm? -68.51 -38.03 80.57 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.578 179.23 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.644 ' CE ' ' HA ' ' A' ' 11' ' ' THR . 0.0 OUTLIER -83.38 -24.18 32.11 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.817 -178.052 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -72.71 -34.57 67.21 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 120.996 0.426 . . . . 0.0 110.87 172.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.462 ' OD1' ' HG ' ' A' ' 31' ' ' LEU . 1.0 OUTLIER -79.3 10.16 3.96 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.987 179.953 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 55.06 31.67 16.67 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.225 177.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.483 HG23 HD11 ' A' ' 13' ' ' LEU . 53.2 t -75.17 150.14 6.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.602 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.439 ' CG ' ' H ' ' A' ' 20' ' ' SER . 6.9 t70 -168.71 -154.7 0.14 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 171.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.439 ' H ' ' CG ' ' A' ' 19' ' ' ASP . 12.3 m -59.69 -27.15 66.17 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -171.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.4 p -83.91 34.77 0.5 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.439 0.638 . . . . 0.0 111.687 -177.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.653 ' CE3' ' HB3' ' A' ' 26' ' ' ARG . 8.9 m95 -133.88 148.35 51.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.044 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 21.7 m -114.01 169.99 8.61 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 169.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.496 ' CZ ' ' HB3' ' A' ' 48' ' ' LYS . 42.6 t80 -83.89 16.75 2.65 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 122.03 0.919 . . . . 0.0 110.875 -170.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.4 m -93.29 -43.93 8.56 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.096 -1.411 . . . . 0.0 107.995 172.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.653 ' HB3' ' CE3' ' A' ' 22' ' ' TRP . 11.8 ttt180 -59.4 -36.35 75.66 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.52 176.295 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.643 ' O ' ' HB2' ' A' ' 31' ' ' LEU . 65.7 mt -64.48 -58.78 5.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.73 177.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.2 mt -62.92 -41.31 92.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 119.898 -0.721 . . . . 0.0 111.641 -178.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.2 m -78.0 -36.91 48.29 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -175.072 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.568 ' HB2' ' O ' ' A' ' 26' ' ' ARG . 48.1 mm-40 -98.17 -36.82 9.93 Favored 'General case' 0 C--O 1.221 -0.436 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -178.234 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.643 ' HB2' ' O ' ' A' ' 27' ' ' ILE . 5.3 mp -83.96 -28.44 27.78 Favored 'General case' 0 CA--C 1.508 -0.637 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.372 -171.336 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.19 -20.24 66.99 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.563 -0.827 . . . . 0.0 111.472 175.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.7 p -108.46 -33.79 6.96 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 178.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 39.9 mtt180 -58.89 -51.29 70.67 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 120.596 0.236 . . . . 0.0 111.141 178.16 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.406 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 6.2 t70 -139.55 129.38 14.13 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-O 121.042 0.449 . . . . 0.0 111.042 -172.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 17.1 Cg_exo -68.76 -8.29 22.95 Favored 'Trans proline' 0 CA--C 1.528 0.183 0 C-N-CA 123.539 2.826 . . . . 0.0 113.036 -178.525 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.612 ' HA ' ' HG3' ' A' ' 40' ' ' MET . 66.1 mtm180 -62.59 -21.57 65.72 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 178.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.602 ' HB2' ' HE1' ' A' ' 12' ' ' MET . 63.9 t80 -66.53 -20.08 65.94 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 177.176 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.403 ' HD1' ' HA ' ' A' ' 36' ' ' PRO . 60.5 m95 -97.89 -18.05 18.92 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.443 -0.799 . . . . 0.0 112.082 -174.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.612 ' HG3' ' HA ' ' A' ' 37' ' ' ARG . 42.8 mtm -55.63 -49.24 73.37 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.614 0.721 . . . . 0.0 109.605 177.312 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.417 HG21 ' CZ3' ' A' ' 47' ' ' TRP . 4.2 p -99.28 122.67 51.33 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 CA-C-N 114.964 -1.017 . . . . 0.0 108.984 172.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -58.36 146.44 34.64 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-O 121.81 0.814 . . . . 0.0 111.166 -174.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.825 ' HA ' ' HZ3' ' A' ' 48' ' ' LYS . 15.1 p-10 -68.87 95.43 0.69 Allowed 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 114.349 -1.296 . . . . 0.0 112.104 -168.695 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -102.31 100.44 15.59 Favored Pre-proline 0 N--CA 1.444 -0.738 0 CA-C-N 114.367 -1.288 . . . . 0.0 107.752 169.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -60.81 -29.69 88.71 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 122.209 1.939 . . . . 0.0 112.325 -173.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.463 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 2.6 tm? -73.37 -39.94 64.75 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -178.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . 0.417 ' CZ3' HG21 ' A' ' 41' ' ' VAL . 42.3 t90 -77.77 -37.56 48.73 Favored 'General case' 0 C--O 1.222 -0.343 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.611 177.222 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.825 ' HZ3' ' HA ' ' A' ' 43' ' ' ASP . 1.4 mptm? -62.38 -31.73 72.44 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 177.26 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.4 mttt -77.92 -40.12 40.67 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.69 0.281 . . . . 0.0 111.019 175.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.463 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 27.0 mt-10 -61.86 -46.1 90.9 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.441 0.639 . . . . 0.0 110.664 179.17 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.653 ' HE2' HG12 ' A' ' 10' ' ' ILE . 0.7 OUTLIER -71.85 -33.37 68.38 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.712 -177.927 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.447 ' CZ ' HD11 ' A' ' 56' ' ' LEU . 26.1 t80 -70.44 -38.3 74.49 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.513 -178.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 50' ' ' GLU . 11.6 pt-20 -72.28 -22.93 61.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.4 0.619 . . . . 0.0 109.818 178.233 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.687 ' HG2' ' HB2' ' A' ' 58' ' ' ASN . 2.7 tmmm? -72.5 -37.15 68.49 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.278 171.051 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.634 ' OH ' ' HA ' ' A' ' 14' ' ' LYS . 54.9 t80 -66.44 -21.95 66.21 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.961 0.41 . . . . 0.0 110.318 176.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.447 HD11 ' CZ ' ' A' ' 52' ' ' PHE . 60.8 mt -95.37 -35.33 11.8 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 178.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 44.0 t -88.57 -55.43 3.72 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.12 0.486 . . . . 0.0 110.579 -178.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.687 ' HB2' ' HG2' ' A' ' 54' ' ' LYS . 5.6 m120 -77.02 -51.62 10.77 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.348 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 59' ' ' ARG . 48.7 mtt180 . . . . . 0 C--O 1.248 0.992 0 O-C-N 123.936 0.773 . . . . 0.0 110.629 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.674 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -91.15 59.53 4.01 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.162 0.506 . . . . 0.0 110.726 -178.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 69.5 mtm -113.14 -81.21 0.59 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.461 178.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -61.25 -46.52 90.05 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.5 0.667 . . . . 0.0 110.522 -178.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.573 ' HB3' ' HB ' ' A' ' 41' ' ' VAL . . . -59.33 -47.36 85.71 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 114.479 -1.237 . . . . 0.0 111.577 -179.295 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -63.33 -47.18 83.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.997 0.427 . . . . 0.0 110.895 -178.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -52.31 -54.22 34.24 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.066 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.4 ' O ' ' HG2' ' A' ' 12' ' ' MET . 29.7 mm-40 -64.72 -36.46 84.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.273 178.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.622 ' O ' HD22 ' A' ' 13' ' ' LEU . 24.9 t80 -61.41 -37.78 84.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.373 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.488 ' CD1' ' HE2' ' A' ' 51' ' ' MET . 23.7 mm -68.71 -38.65 79.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.131 0.491 . . . . 0.0 110.264 177.067 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.8 m -69.53 -41.67 75.68 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.573 -177.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.507 ' SD ' ' HA ' ' A' ' 9' ' ' PHE . 24.1 ptm -69.11 -26.81 65.1 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 -179.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.622 HD22 ' O ' ' A' ' 9' ' ' PHE . 1.3 mm? -69.27 -38.31 78.31 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.36 179.038 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -70.89 -42.33 70.13 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.03 0.443 . . . . 0.0 110.531 174.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -69.34 -28.89 66.62 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.169 -176.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.405 HD21 ' N ' ' A' ' 16' ' ' ASN . 0.9 OUTLIER -85.81 8.65 19.2 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.929 0.395 . . . . 0.0 110.09 175.473 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 59.61 32.5 21.6 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 115.265 -0.879 . . . . 0.0 112.616 175.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.491 HG21 HD12 ' A' ' 13' ' ' LEU . 41.5 t -77.43 141.72 15.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.949 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -154.01 -159.71 1.01 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.95 172.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.68 ' HA ' HD22 ' A' ' 56' ' ' LEU . 16.9 m -60.25 -27.01 66.89 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -176.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 41.5 p -85.3 45.91 1.23 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 121.181 0.515 . . . . 0.0 111.563 -178.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.574 ' CE2' ' HD3' ' A' ' 26' ' ' ARG . 5.5 m95 -139.61 146.82 40.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.607 -177.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 93.7 p -105.12 170.22 8.0 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 170.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.432 ' CE1' ' HB3' ' A' ' 48' ' ' LYS . 61.4 t80 -85.2 15.37 4.28 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 122.133 0.968 . . . . 0.0 109.454 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.9 t -92.75 -41.02 10.36 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 113.859 -1.519 . . . . 0.0 107.335 172.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.574 ' HD3' ' CE2' ' A' ' 22' ' ' TRP . 18.1 ttt180 -65.74 -32.86 74.63 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 114.327 -1.306 . . . . 0.0 109.635 177.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.709 HG21 HD22 ' A' ' 31' ' ' LEU . 33.4 mt -63.08 -54.46 33.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.198 174.383 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.5 mt -62.37 -32.71 55.9 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 120.411 -0.515 . . . . 0.0 111.893 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.51 ' HG ' ' HG2' ' A' ' 30' ' ' GLU . 96.9 p -85.51 -37.89 19.17 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -174.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.51 ' HG2' ' HG ' ' A' ' 29' ' ' SER . 40.0 mm-40 -101.56 -35.75 9.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.902 0.382 . . . . 0.0 111.497 -174.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.709 HD22 HG21 ' A' ' 27' ' ' ILE . 5.3 mp -86.43 -16.33 37.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.388 0.613 . . . . 0.0 109.662 -174.432 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -81.05 -3.79 90.62 Favored Glycine 0 N--CA 1.442 -0.933 0 CA-C-N 115.199 -0.909 . . . . 0.0 111.904 177.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 41.3 p -129.04 -38.25 1.64 Allowed 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -176.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.456 ' HE ' ' HB3' ' A' ' 30' ' ' GLU . 89.9 mtt-85 -54.84 -45.63 74.53 Favored 'General case' 0 C--O 1.232 0.174 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -176.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.41 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 2.8 p30 -155.92 138.95 10.75 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 172.429 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.49 ' O ' ' HG3' ' A' ' 40' ' ' MET . 16.7 Cg_exo -68.98 14.45 0.2 Allowed 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 123.457 2.771 . . . . 0.0 114.474 -171.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 43.3 mtm180 -63.35 -28.72 70.19 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 122.128 -0.357 . . . . 0.0 111.043 177.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -68.02 -17.44 64.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.387 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 56.2 m95 -106.95 -24.37 12.04 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.921 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.49 ' HG3' ' O ' ' A' ' 36' ' ' PRO . 89.2 mtp -56.14 -49.89 72.67 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 174.185 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.573 ' HB ' ' HB3' ' A' ' 5' ' ' ALA . 2.9 p -86.25 123.37 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.354 -0.839 . . . . 0.0 108.77 169.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -58.58 144.32 43.22 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-O 121.729 0.776 . . . . 0.0 111.275 -174.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.521 ' HA ' ' HZ2' ' A' ' 48' ' ' LYS . 8.0 p-10 -73.12 97.32 2.35 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 114.726 -1.124 . . . . 0.0 111.987 -171.124 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -103.05 97.98 10.76 Favored Pre-proline 0 C--N 1.318 -0.766 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 164.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.68 ' O ' ' HB3' ' A' ' 49' ' ' LYS . 17.3 Cg_exo -66.74 -22.21 50.23 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.302 2.001 . . . . 0.0 112.417 -172.51 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 46' ' ' LEU . 0.3 OUTLIER -82.3 -37.82 25.24 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 179.586 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 45.4 t90 -74.68 -38.75 62.32 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.54 175.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.591 ' HG3' ' CZ ' ' A' ' 9' ' ' PHE . 1.4 mptm? -61.18 -32.41 72.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.035 0.445 . . . . 0.0 110.138 176.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.68 ' HB3' ' O ' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -88.59 -33.07 17.8 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.763 -176.493 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -62.9 -47.94 81.12 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.378 0.608 . . . . 0.0 110.257 171.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.488 ' HE2' ' CD1' ' A' ' 10' ' ' ILE . 1.5 ppp? -71.63 -24.12 61.81 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.032 -176.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.536 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 20.3 t80 -69.25 -36.45 77.16 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.095 174.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -65.9 -28.22 68.78 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.184 0.516 . . . . 0.0 109.943 174.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 10.1 tttm -72.58 -37.15 68.26 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.408 172.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.493 ' HA ' ' HA ' ' A' ' 59' ' ' ARG . 63.5 t80 -72.39 -18.8 61.7 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.125 0.488 . . . . 0.0 110.983 -179.114 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.68 HD22 ' HA ' ' A' ' 20' ' ' SER . 72.9 mt -92.28 -32.63 14.95 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 120.839 0.352 . . . . 0.0 111.073 176.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.3 t -85.68 -48.99 8.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.964 0.411 . . . . 0.0 110.754 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -102.6 -45.24 5.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.904 -179.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.493 ' HA ' ' HA ' ' A' ' 55' ' ' TYR . 40.3 ttm180 . . . . . 0 C--O 1.249 1.03 0 CA-C-O 117.957 -1.021 . . . . 0.0 110.733 178.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.689 0 N-CA-C 111.71 -0.556 . . . . 0.0 111.71 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.759 ' HB3' ' HB1' ' A' ' 5' ' ' ALA . . . -87.69 74.53 9.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.019 0.438 . . . . 0.0 110.206 -178.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.536 ' O ' ' HG3' ' A' ' 7' ' ' LYS . 26.6 mmt -72.25 -62.5 1.41 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.248 -172.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -68.76 -31.69 70.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.003 0.43 . . . . 0.0 109.963 -178.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.759 ' HB1' ' HB3' ' A' ' 2' ' ' ALA . . . -61.65 -44.47 96.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.723 176.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -61.45 -47.32 86.24 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 121.076 0.465 . . . . 0.0 110.466 175.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.536 ' HG3' ' O ' ' A' ' 3' ' ' MET . 48.9 mtpt -55.96 -49.48 73.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.405 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -65.04 -31.16 72.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.851 0.358 . . . . 0.0 110.949 178.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.529 ' HA ' ' HE3' ' A' ' 12' ' ' MET . 1.4 t80 -69.84 -40.21 75.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.94 -179.38 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.5 mm -73.5 -37.16 49.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.185 0.517 . . . . 0.0 110.144 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 26.8 m -65.56 -31.97 73.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.402 176.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.529 ' HE3' ' HA ' ' A' ' 9' ' ' PHE . 24.0 ttp -75.06 -33.91 61.76 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 115.322 -0.853 . . . . 0.0 108.944 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.456 HD12 HG12 ' A' ' 18' ' ' VAL . 0.2 OUTLIER -68.85 -38.88 80.07 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.835 -179.017 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.4 mppt? -73.89 -32.55 63.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.871 0.367 . . . . 0.0 110.904 177.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -69.2 -20.62 63.98 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.585 176.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -106.65 17.48 23.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.657 -0.247 . . . . 0.0 111.471 179.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.1 mm100 53.6 30.98 11.69 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.592 175.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.456 HG12 HD12 ' A' ' 13' ' ' LEU . 58.7 t -68.5 136.84 25.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.742 -177.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.437 ' CG ' ' H ' ' A' ' 20' ' ' SER . 5.6 t70 -148.62 -156.37 0.71 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 177.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.437 ' H ' ' CG ' ' A' ' 19' ' ' ASP . 9.8 p -74.37 -15.07 60.94 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.003 -176.081 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.3 t -83.13 -3.45 57.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.412 0.625 . . . . 0.0 110.739 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.561 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 6.0 m95 -92.18 128.32 37.99 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.112 176.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 70.8 p -95.71 174.63 6.88 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.49 -0.929 . . . . 0.0 108.49 170.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.522 ' CD1' HD11 ' A' ' 27' ' ' ILE . 27.8 t80 -86.5 15.18 5.74 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.132 178.246 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.8 t -93.23 -33.14 14.09 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 113.897 -1.501 . . . . 0.0 107.211 171.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.561 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 31.6 ttt180 -72.58 -33.71 66.94 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.285 176.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.552 HG23 HD22 ' A' ' 31' ' ' LEU . 45.8 mt -65.12 -39.13 84.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.509 176.048 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 72.8 mt -76.27 -44.0 36.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 C-N-CA 119.594 -0.842 . . . . 0.0 111.572 173.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 99.0 p -74.38 -38.07 63.26 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -171.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.551 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 50.2 mm-40 -109.96 -37.64 5.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.224 0.535 . . . . 0.0 111.226 -177.08 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.552 HD22 HG23 ' A' ' 27' ' ' ILE . 11.6 tp -87.84 -12.78 43.91 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.857 -162.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -83.28 -15.68 71.13 Favored Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.47 -0.872 . . . . 0.0 111.719 176.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.4 p -120.28 -26.96 5.34 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.551 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 46.5 mtt180 -57.12 -40.01 76.23 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.618 0.247 . . . . 0.0 111.104 178.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.486 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 8.8 t70 -152.58 129.89 5.79 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.412 179.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 22.3 Cg_exo -66.37 -0.89 4.74 Favored 'Trans proline' 0 CA--C 1.531 0.357 0 C-N-CA 123.658 2.905 . . . . 0.0 113.824 -177.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.416 ' HE ' ' CG ' ' A' ' 35' ' ' ASP . 68.2 mtm180 -61.36 -21.27 63.88 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 175.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -68.07 -18.67 64.74 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.221 0.534 . . . . 0.0 109.795 175.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 53.5 m95 -104.35 -17.29 14.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.409 -176.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 32.6 tpp -60.84 -38.55 85.86 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 121.243 0.544 . . . . 0.0 109.564 176.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.653 ' HB ' ' HB3' ' A' ' 5' ' ' ALA . 7.2 p -93.61 139.36 18.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.123 171.355 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -64.6 145.69 55.79 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-O 121.727 0.775 . . . . 0.0 111.778 -176.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -68.39 96.68 0.69 Allowed 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.155 -1.384 . . . . 0.0 112.051 -171.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.49 ' O ' ' HD3' ' A' ' 48' ' ' LYS . 9.8 t70 -122.24 98.31 44.43 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 114.877 -1.056 . . . . 0.0 108.623 169.074 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.401 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 41.2 Cg_exo -60.52 -32.49 93.65 Favored 'Trans proline' 0 CA--C 1.516 -0.409 0 C-N-CA 122.937 2.425 . . . . 0.0 112.758 -174.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.68 -38.35 58.77 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.952 -178.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . 0.498 ' CZ3' HG22 ' A' ' 41' ' ' VAL . 71.2 t90 -73.2 -36.6 66.55 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.896 -0.321 . . . . 0.0 110.147 174.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.49 ' HE2' ' HE2' ' A' ' 9' ' ' PHE . 2.3 mptm? -61.07 -34.1 74.37 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.717 -0.393 . . . . 0.0 109.944 176.227 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.48 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 33.3 mttt -78.72 -40.66 32.97 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 120.875 0.369 . . . . 0.0 110.59 178.329 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -65.96 -43.41 88.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.414 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.457 ' HE3' ' HB2' ' A' ' 51' ' ' MET . 2.8 ppp? -73.28 -29.02 62.44 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 -178.796 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -69.79 -37.95 76.51 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.423 176.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' A' ' 49' ' ' LYS . 92.5 mt-10 -69.6 -26.5 64.48 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 175.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 40.8 tptt -72.98 -37.52 67.0 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.224 0.535 . . . . 0.0 109.618 174.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.452 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 80.1 t80 -63.18 -30.4 71.55 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.684 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 64.6 mt -89.97 -32.83 16.62 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.408 179.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.4 t -79.79 -48.71 13.13 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.878 0.37 . . . . 0.0 111.466 -178.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -100.79 -45.76 5.36 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.547 -176.106 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.452 ' HG2' ' O ' ' A' ' 55' ' ' TYR . 3.1 mmt180 . . . . . 0 C--O 1.249 1.066 0 O-C-N 123.89 0.744 . . . . 0.0 110.751 176.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.51 0 N-CA-C 111.942 -0.463 . . . . 0.0 111.942 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 58.05 28.95 17.05 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 123.409 0.683 . . . . 0.0 112.089 178.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 68.8 mtm -83.25 -54.05 5.3 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 121.067 -0.253 . . . . 0.0 110.886 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -57.07 -42.98 81.64 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.402 0.62 . . . . 0.0 109.934 175.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.596 ' HB3' ' HB ' ' A' ' 41' ' ' VAL . . . -60.43 -47.29 86.75 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 114.746 -1.115 . . . . 0.0 111.129 178.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -59.15 -49.71 76.84 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.107 0.479 . . . . 0.0 110.395 178.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.424 ' HD2' ' HA ' ' A' ' 7' ' ' LYS . 12.9 mmmm -54.54 -44.85 73.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.945 -179.262 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.427 ' HB3' ' HD3' ' A' ' 37' ' ' ARG . 40.9 mt-10 -75.88 -25.53 56.22 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.036 179.421 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.477 ' HA ' ' HE3' ' A' ' 12' ' ' MET . 12.8 t80 -72.31 -39.9 67.9 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.828 178.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.615 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 39.2 mm -68.57 -38.73 79.52 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.222 0 CA-C-O 121.389 0.614 . . . . 0.0 109.939 177.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.0 m -67.62 -29.68 69.06 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.049 176.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.477 ' HE3' ' HA ' ' A' ' 9' ' ' PHE . 42.7 ttp -77.24 -29.43 54.07 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.334 -178.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.453 HD11 HG12 ' A' ' 18' ' ' VAL . 0.2 OUTLIER -71.21 -38.58 72.03 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.733 179.367 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.615 ' HD3' ' O ' ' A' ' 10' ' ' ILE . 0.3 OUTLIER -74.38 -31.89 62.54 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.691 176.775 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -63.43 -32.09 73.43 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.354 175.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -98.15 10.28 40.9 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.485 -177.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 55.4 mm-40 58.11 31.92 21.34 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.911 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.453 HG12 HD11 ' A' ' 13' ' ' LEU . 65.1 t -69.92 123.31 23.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.617 -176.19 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -142.07 -159.45 0.97 Allowed 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 170.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.5 t -59.02 -17.32 24.09 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -176.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.2 t -77.67 -3.78 42.79 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 122.133 -0.354 . . . . 0.0 111.414 178.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.527 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 7.8 m95 -99.43 138.1 37.0 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.234 176.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 87.7 p -110.5 178.91 4.23 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 170.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.529 ' CD1' HD12 ' A' ' 27' ' ' ILE . 15.9 t80 -86.14 16.69 4.1 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.999 0.904 . . . . 0.0 109.272 178.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.7 t -93.48 -38.18 11.55 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 169.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.527 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 29.3 ttt180 -71.56 -33.32 69.01 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 114.049 -1.432 . . . . 0.0 109.166 177.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.542 HG12 HD22 ' A' ' 31' ' ' LEU . 29.3 mt -64.92 -50.24 75.97 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.391 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.121 173.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.461 HG12 ' O ' ' A' ' 24' ' ' PHE . 44.6 mm -62.59 -43.19 98.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 119.822 -0.751 . . . . 0.0 111.198 177.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 48.4 t -70.58 -38.59 74.08 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -176.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.478 ' HB3' ' HE ' ' A' ' 34' ' ' ARG . 20.4 mm-40 -113.83 -34.95 5.29 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -171.196 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.542 HD22 HG12 ' A' ' 27' ' ' ILE . 0.5 OUTLIER -87.65 -26.36 23.06 Favored 'General case' 0 C--N 1.319 -0.754 0 O-C-N 121.771 -0.581 . . . . 0.0 111.01 -175.106 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -86.1 9.19 70.5 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.707 -0.759 . . . . 0.0 111.518 175.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 46.0 p -132.02 -54.0 0.98 Allowed 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -177.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.478 ' HE ' ' HB3' ' A' ' 30' ' ' GLU . 65.9 mtt-85 -52.87 -46.06 67.74 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -177.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.48 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 9.3 t70 -139.21 132.84 15.86 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.999 -171.071 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.48 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 17.3 Cg_exo -68.29 -2.21 8.6 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 123.32 2.68 . . . . 0.0 113.35 -178.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.65 ' HG2' ' HE3' ' A' ' 40' ' ' MET . 48.0 mtm180 -56.13 -30.32 61.96 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 176.321 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.407 ' CE1' ' HD2' ' A' ' 48' ' ' LYS . 67.7 t80 -69.5 -21.76 63.65 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.767 0.318 . . . . 0.0 110.393 178.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 62.6 m95 -104.08 -19.98 13.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.93 -174.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.65 ' HE3' ' HG2' ' A' ' 37' ' ' ARG . 38.2 mtm -60.8 -39.64 89.66 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.474 0.654 . . . . 0.0 109.559 177.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.596 ' HB ' ' HB3' ' A' ' 5' ' ' ALA . 5.2 p -88.38 130.65 37.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.102 -0.953 . . . . 0.0 108.664 169.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.23 136.74 58.05 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-O 121.447 0.642 . . . . 0.0 109.637 178.061 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.402 ' O ' ' HD3' ' A' ' 45' ' ' PRO . 29.5 t70 -75.88 96.47 3.72 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 114.882 -1.053 . . . . 0.0 112.091 -166.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -100.84 95.91 5.02 Favored Pre-proline 0 C--N 1.321 -0.643 0 N-CA-C 107.113 -1.439 . . . . 0.0 107.113 165.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.602 ' HA ' ' HB2' ' A' ' 48' ' ' LYS . 19.4 Cg_exo -67.11 -23.56 45.8 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 122.421 2.08 . . . . 0.0 112.107 -171.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -71.24 -38.32 71.95 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 56.4 t90 -75.72 -38.27 58.7 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 172.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.602 ' HB2' ' HA ' ' A' ' 45' ' ' PRO . 27.0 mmtp -61.01 -35.81 77.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.328 179.171 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.513 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 43.8 mttt -80.38 -40.29 26.81 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.669 179.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -66.14 -37.95 86.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.321 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 1.3 ppp? -71.73 -32.85 68.18 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.485 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 35.6 t80 -71.01 -37.96 72.65 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.665 176.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.513 ' HG2' ' O ' ' A' ' 49' ' ' LYS . 24.2 mm-40 -66.51 -30.84 71.25 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 175.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -72.45 -37.96 68.4 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.2 178.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.667 ' HA ' ' HA ' ' A' ' 59' ' ' ARG . 75.7 t80 -70.98 -24.51 62.41 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.75 -177.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 82.8 mt -87.95 -34.02 18.24 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.791 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.6 p -86.35 -41.11 14.79 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.952 0.406 . . . . 0.0 111.407 -178.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -118.13 -42.17 2.82 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.163 -176.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.667 ' HA ' ' HA ' ' A' ' 55' ' ' TYR . 39.0 ttm180 . . . . . 0 C--O 1.247 0.943 0 CA-C-O 118.123 -0.942 . . . . 0.0 110.378 -177.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.701 0 N-CA-C 111.978 -0.449 . . . . 0.0 111.978 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 58.42 24.15 11.43 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 176.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.484 ' O ' ' HG2' ' A' ' 7' ' ' LYS . 34.4 mmt -87.33 -46.13 9.96 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 122.249 -0.282 . . . . 0.0 110.336 -178.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -68.15 -35.0 77.36 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 176.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.506 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -64.25 -41.21 97.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.388 175.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.491 ' O ' HG12 ' A' ' 10' ' ' ILE . 29.8 tt0 -57.39 -47.03 82.74 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.038 176.572 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.561 ' HE2' ' N ' ' A' ' 7' ' ' LYS . 9.4 mmpt? -52.5 -52.35 54.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.446 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -62.78 -39.02 92.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.551 178.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.513 ' CE2' ' HG3' ' A' ' 48' ' ' LYS . 16.2 t80 -63.11 -39.48 94.81 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.465 -178.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.573 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 47.4 mm -74.31 -37.11 44.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.183 0.516 . . . . 0.0 110.226 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 29.9 m -64.11 -34.82 78.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.597 0.713 . . . . 0.0 110.289 176.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.457 ' HE2' ' HA ' ' A' ' 9' ' ' PHE . 33.4 ttp -75.93 -30.68 58.8 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.281 179.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.404 HD13 HG11 ' A' ' 18' ' ' VAL . 0.1 OUTLIER -70.36 -38.41 74.77 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.042 179.128 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.573 ' HD3' ' O ' ' A' ' 10' ' ' ILE . 0.0 OUTLIER -72.18 -33.48 67.7 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.756 0.313 . . . . 0.0 110.485 176.258 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -66.19 -26.76 67.55 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 121.288 0.566 . . . . 0.0 111.511 176.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 -102.02 14.57 31.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.785 -177.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 53.95 31.42 13.39 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.849 175.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.436 ' O ' ' HE2' ' A' ' 55' ' ' TYR . 66.4 t -67.12 136.06 27.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.245 0.545 . . . . 0.0 111.634 -173.082 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -157.94 -160.21 0.89 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.349 175.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 p -55.51 -24.39 31.47 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 123.383 0.427 . . . . 0.0 112.098 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.6 p -69.96 -11.17 60.67 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 120.972 0.415 . . . . 0.0 112.0 -179.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.579 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 11.5 m95 -95.75 133.83 39.39 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.169 0.509 . . . . 0.0 110.969 179.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 m -105.86 168.54 9.05 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 168.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.576 ' CD1' HD13 ' A' ' 27' ' ' ILE . 18.9 t80 -82.5 15.78 2.39 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 122.087 0.946 . . . . 0.0 109.912 -176.261 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.6 t -92.84 -34.3 13.89 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.173 -1.376 . . . . 0.0 107.674 170.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.579 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 40.8 ttt180 -70.14 -36.14 74.56 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.618 -1.174 . . . . 0.0 108.99 178.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.6 HG22 HD21 ' A' ' 31' ' ' LEU . 52.4 mt -64.77 -47.14 89.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.334 176.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.6 mt -70.51 -42.79 78.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 C-N-CA 119.546 -0.861 . . . . 0.0 111.705 177.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.3 t -77.55 -39.02 47.35 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -171.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.489 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 22.9 mm-40 -111.52 -35.39 5.81 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 121.077 0.465 . . . . 0.0 111.345 -174.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.6 HD21 HG22 ' A' ' 27' ' ' ILE . 11.4 tp -84.87 -36.67 21.39 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.478 -168.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -68.07 -17.42 69.83 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.763 174.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 65.1 p -107.1 -1.9 21.54 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 122.452 -0.44 . . . . 0.0 111.564 -178.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.489 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 60.3 mtt-85 -88.99 -47.37 8.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.542 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.511 ' OD1' ' HG3' ' A' ' 37' ' ' ARG . 11.8 t70 -149.32 137.41 11.71 Favored Pre-proline 0 C--N 1.325 -0.469 0 C-N-CA 120.904 -0.319 . . . . 0.0 111.222 -172.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.497 ' HA ' ' HD1' ' A' ' 39' ' ' TRP . 34.2 Cg_exo -63.32 -7.02 11.15 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.681 2.92 . . . . 0.0 113.959 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.511 ' HG3' ' OD1' ' A' ' 35' ' ' ASP . 47.0 mtm180 -56.41 -28.79 60.4 Favored 'General case' 0 CA--C 1.529 0.146 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 174.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -71.96 -20.27 61.76 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.816 0.341 . . . . 0.0 110.686 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.497 ' HD1' ' HA ' ' A' ' 36' ' ' PRO . 56.7 m95 -106.81 -23.53 12.36 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.436 -175.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 39.3 ttm -51.91 -47.3 64.68 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 121.36 0.6 . . . . 0.0 109.951 175.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.559 HG11 ' HZ2' ' A' ' 48' ' ' LYS . 2.5 p -87.43 116.67 30.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 167.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -58.19 145.42 37.23 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 121.464 0.649 . . . . 0.0 110.98 -173.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -63.33 98.09 0.15 Allowed 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.25 -1.341 . . . . 0.0 113.909 -164.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -111.11 95.94 27.65 Favored Pre-proline 0 N--CA 1.426 -1.628 0 CA-C-N 113.121 -1.854 . . . . 0.0 108.97 166.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_exo -67.71 -32.87 29.28 Favored 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 122.663 2.242 . . . . 0.0 112.662 -173.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.682 ' HA ' ' HE3' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -70.63 -36.39 73.44 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.881 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . 0.508 ' O ' ' HG2' ' A' ' 51' ' ' MET . 39.6 t90 -74.2 -39.27 63.26 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 119.608 -0.837 . . . . 0.0 110.111 175.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.559 ' HZ2' HG11 ' A' ' 41' ' ' VAL . 0.0 OUTLIER -63.83 -32.77 74.39 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 176.312 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.682 ' HE3' ' HA ' ' A' ' 46' ' ' LEU . 12.0 ptpt -78.72 -38.59 38.62 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.136 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -68.52 -42.03 79.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.642 179.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.508 ' HG2' ' O ' ' A' ' 47' ' ' TRP . 15.6 ptm -74.22 -26.65 60.38 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.528 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 39.8 t80 -70.33 -37.15 74.63 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-N 115.938 -0.573 . . . . 0.0 109.605 175.03 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -66.57 -30.85 71.25 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.941 175.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -72.85 -37.39 67.43 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-O 121.353 0.597 . . . . 0.0 109.904 177.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.436 ' HE2' ' O ' ' A' ' 18' ' ' VAL . 75.1 t80 -71.49 -24.71 62.03 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.643 -178.094 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 40.2 mt -93.7 -33.47 13.63 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.369 178.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 21.2 t -100.06 25.06 7.8 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.36 0.6 . . . . 0.0 110.664 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -171.11 -66.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.051 177.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 55' ' ' TYR . 36.6 ttm180 . . . . . 0 C--O 1.249 1.038 0 O-C-N 124.333 1.02 . . . . 0.0 109.543 -172.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.703 0 N-CA-C 111.967 -0.453 . . . . 0.0 111.967 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 63.23 26.49 15.21 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 122.956 0.502 . . . . 0.0 111.343 178.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 18.6 ttt -67.5 -50.77 57.43 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 121.583 0.706 . . . . 0.0 110.007 179.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -62.7 -44.04 97.26 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.028 178.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.646 ' HB2' ' HB ' ' A' ' 41' ' ' VAL . . . -60.31 -45.03 94.81 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.24 177.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.434 ' O ' HG12 ' A' ' 10' ' ' ILE . 29.2 tt0 -57.34 -54.39 47.38 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 121.131 0.491 . . . . 0.0 110.254 177.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.1 ttpt -50.15 -50.35 49.19 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.009 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -61.09 -40.18 92.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.046 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.604 ' CZ ' ' HG3' ' A' ' 48' ' ' LYS . 25.4 t80 -67.38 -40.1 85.68 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.91 -177.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.46 HG23 ' HE3' ' A' ' 14' ' ' LYS . 40.1 mm -74.88 -36.34 38.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.28 0.562 . . . . 0.0 110.284 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.4 m -71.38 -28.11 63.8 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.406 177.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.574 ' HE2' ' HA ' ' A' ' 9' ' ' PHE . 27.2 ttp -74.47 -34.6 63.16 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 177.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.423 HD12 HG13 ' A' ' 18' ' ' VAL . 0.1 OUTLIER -68.59 -38.03 80.31 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.04 178.396 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.46 ' HE3' HG23 ' A' ' 10' ' ' ILE . 33.6 mttt -68.81 -43.15 76.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.205 0.526 . . . . 0.0 111.04 176.504 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -66.08 -29.64 70.01 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.025 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -91.68 11.19 25.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.657 0.265 . . . . 0.0 111.087 177.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 55.29 31.84 17.43 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.535 176.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.423 HG13 HD12 ' A' ' 13' ' ' LEU . 58.7 t -65.73 130.04 30.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.405 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -140.87 -164.15 1.68 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.429 176.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.2 p -56.21 -28.31 57.85 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -178.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 79.6 p -75.39 -6.77 51.7 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.027 0.441 . . . . 0.0 111.999 -176.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.74 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 9.8 m95 -89.38 126.08 35.4 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.112 0.482 . . . . 0.0 111.442 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.449 ' C ' ' H ' ' A' ' 25' ' ' SER . 30.4 t -83.89 155.65 22.79 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 167.54 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.563 ' CZ ' ' HB3' ' A' ' 48' ' ' LYS . 91.0 t80 -81.0 15.35 1.87 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-O 122.709 1.242 . . . . 0.0 109.356 -179.026 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.449 ' H ' ' C ' ' A' ' 23' ' ' SER . 15.1 t -92.28 -30.72 15.71 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 113.136 -1.847 . . . . 0.0 107.366 171.342 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.74 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 62.7 ttt180 -73.49 -37.63 65.66 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 114.478 -1.237 . . . . 0.0 109.59 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.541 ' O ' ' HB2' ' A' ' 31' ' ' LEU . 64.5 mt -63.12 -52.33 60.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.615 175.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 76.6 mt -61.11 -42.16 92.15 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 120.069 -0.652 . . . . 0.0 111.27 178.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.2 t -77.97 -39.13 43.51 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -172.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.579 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 12.8 mt-10 -107.33 -37.07 6.34 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.973 -0.691 . . . . 0.0 111.993 -176.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.541 ' HB2' ' O ' ' A' ' 27' ' ' ILE . 1.2 mp -78.13 -31.11 49.69 Favored 'General case' 0 C--N 1.323 -0.566 0 O-C-N 122.025 -0.422 . . . . 0.0 111.315 -172.034 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.11 -32.84 67.82 Favored Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.546 176.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.7 t -104.32 -19.39 14.1 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -178.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.579 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 62.2 mtt-85 -74.63 -34.39 62.77 Favored 'General case' 0 CA--C 1.517 -0.302 0 O-C-N 122.316 -0.24 . . . . 0.0 111.628 179.216 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.475 ' HB3' ' SD ' ' A' ' 12' ' ' MET . 8.7 t0 -147.76 129.78 7.53 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-O 120.994 0.426 . . . . 0.0 111.087 -175.397 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 16.9 Cg_exo -68.71 -6.0 16.81 Favored 'Trans proline' 0 CA--C 1.529 0.251 0 C-N-CA 123.363 2.708 . . . . 0.0 112.795 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.5 ' HA ' ' HG2' ' A' ' 40' ' ' MET . 51.9 mtt180 -61.69 -25.08 67.18 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.625 0.231 . . . . 0.0 111.625 176.386 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -68.13 -21.64 64.92 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 176.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 48.6 m95 -99.36 -17.13 18.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.485 -177.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.5 ' HG2' ' HA ' ' A' ' 37' ' ' ARG . 86.2 mmm -49.61 -38.62 32.52 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.317 0.579 . . . . 0.0 110.564 175.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.646 ' HB ' ' HB2' ' A' ' 5' ' ' ALA . 3.5 p -113.07 129.95 67.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.084 173.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.45 143.12 50.8 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-O 121.45 0.643 . . . . 0.0 109.714 177.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.455 ' O ' ' HD3' ' A' ' 45' ' ' PRO . 25.6 t0 -76.79 99.31 5.09 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.05 -0.977 . . . . 0.0 113.153 -160.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -96.22 99.26 5.01 Favored Pre-proline 0 C--N 1.324 -0.536 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 166.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.455 ' HD3' ' O ' ' A' ' 43' ' ' ASP . 37.6 Cg_exo -62.38 -30.32 80.48 Favored 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 122.934 2.423 . . . . 0.0 112.765 -174.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.464 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 1.1 tm? -71.18 -39.03 72.1 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.219 -0.659 . . . . 0.0 109.219 -179.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . 0.467 ' O ' ' HG2' ' A' ' 51' ' ' MET . 42.5 t90 -75.2 -38.53 60.7 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.454 176.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.604 ' HG3' ' CZ ' ' A' ' 9' ' ' PHE . 2.1 mptm? -62.83 -33.99 76.39 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.628 177.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.417 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 33.4 mttt -75.37 -38.75 59.83 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.477 176.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.464 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 32.3 mt-10 -62.37 -47.48 84.0 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.264 177.514 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.467 ' HG2' ' O ' ' A' ' 47' ' ' TRP . 13.5 ptm -73.13 -22.74 60.47 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.098 -176.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.495 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 24.0 t80 -76.97 -38.43 53.26 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.53 176.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 49' ' ' LYS . 47.2 mm-40 -67.31 -33.83 76.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.924 0.393 . . . . 0.0 110.019 176.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.2 tttt -72.32 -37.73 68.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.866 175.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -61.85 -31.75 72.04 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.52 178.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 83.1 mt -84.15 -33.28 24.29 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -178.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 72.4 p -106.26 9.16 32.13 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -175.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.479 ' O ' ' HB2' ' A' ' 59' ' ' ARG . 0.2 OUTLIER -153.09 -49.79 0.1 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.741 -0.209 . . . . 0.0 110.498 -176.759 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.479 ' HB2' ' O ' ' A' ' 58' ' ' ASN . 50.9 mtt180 . . . . . 0 C--O 1.247 0.931 0 O-C-N 124.113 0.883 . . . . 0.0 110.168 -178.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.738 0 N-CA-C 112.104 -0.398 . . . . 0.0 112.104 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -86.84 22.25 2.03 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.85 0.357 . . . . 0.0 111.429 -175.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.425 ' O ' ' HG3' ' A' ' 7' ' ' LYS . 65.0 mtm -106.89 -62.09 1.45 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.16 0.505 . . . . 0.0 109.997 177.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -58.49 -56.56 20.61 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.963 -175.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.605 ' HB3' ' HB ' ' A' ' 41' ' ' VAL . . . -64.67 -34.44 78.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.647 -176.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.603 ' HG3' ' HE3' ' A' ' 51' ' ' MET . 34.6 tt0 -62.99 -52.87 61.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.898 0.38 . . . . 0.0 110.025 178.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' A' ' 3' ' ' MET . 45.8 mtpt -64.33 -35.91 82.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.689 -179.269 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -61.66 -37.78 85.33 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.938 0.399 . . . . 0.0 110.185 174.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.564 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 30.3 t80 -71.43 -39.28 71.15 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.32 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.529 HG12 ' O ' ' A' ' 6' ' ' GLU . 47.5 mm -71.39 -37.7 66.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.281 0.562 . . . . 0.0 110.399 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 38.9 m -72.77 -24.37 60.94 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.193 175.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.732 ' HB2' ' HD2' ' A' ' 37' ' ' ARG . 46.7 ttp -75.18 -33.14 61.41 Favored 'General case' 0 CA--C 1.509 -0.611 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 178.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 9' ' ' PHE . 80.1 mt -68.06 -38.3 82.3 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.108 176.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 62.7 mttt -69.55 -40.38 76.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.256 0.551 . . . . 0.0 111.039 176.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -73.97 -13.32 60.86 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.823 179.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.519 ' OD1' ' HD2' ' A' ' 34' ' ' ARG . 0.9 OUTLIER -106.66 10.82 30.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.841 0.353 . . . . 0.0 110.644 177.546 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 41.9 mm-40 56.37 31.83 19.43 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.014 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.455 HG12 HD22 ' A' ' 13' ' ' LEU . 58.3 t -75.71 140.95 16.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.786 -178.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -157.94 -158.81 0.76 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.026 -0.533 . . . . 0.0 109.597 172.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.7 p -51.23 -32.25 23.52 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.1 t -85.32 25.86 0.96 Allowed 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.42 0.628 . . . . 0.0 111.88 -174.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.671 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 3.6 m95 -115.89 140.73 48.95 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.955 0.407 . . . . 0.0 110.873 178.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 84.9 p -97.08 168.49 10.42 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 173.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.422 ' CD1' HD12 ' A' ' 27' ' ' ILE . 41.7 t80 -89.04 15.75 8.19 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 122.172 0.987 . . . . 0.0 108.957 177.081 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.0 m -94.14 -42.9 8.74 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 113.842 -1.526 . . . . 0.0 107.462 170.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.671 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 19.7 ttt180 -60.58 -38.05 83.32 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 113.57 -1.65 . . . . 0.0 109.437 174.431 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.744 HG23 HD22 ' A' ' 31' ' ' LEU . 50.7 mt -61.15 -58.25 8.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.64 175.223 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 71.3 mt -60.18 -34.78 58.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.543 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.4 t -79.24 -38.85 34.61 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -174.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 26.8 mm-40 -104.05 -34.55 8.39 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 -173.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.744 HD22 HG23 ' A' ' 27' ' ' ILE . 5.1 mp -86.47 -15.06 41.33 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.434 0.635 . . . . 0.0 109.725 -176.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -83.34 -5.53 88.67 Favored Glycine 0 N--CA 1.439 -1.108 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.275 174.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 23.7 p -128.02 -45.44 1.41 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -175.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.519 ' HD2' ' OD1' ' A' ' 16' ' ' ASN . 47.1 mtt180 -53.5 -44.86 69.4 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -177.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.435 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 16.6 t70 -160.34 129.44 3.15 Favored Pre-proline 0 C--N 1.323 -0.559 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 177.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.494 ' O ' ' HG3' ' A' ' 40' ' ' MET . 16.3 Cg_exo -69.46 27.56 0.17 Allowed 'Trans proline' 0 CA--C 1.533 0.438 0 C-N-CA 123.577 2.852 . . . . 0.0 114.851 -171.241 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.732 ' HD2' ' HB2' ' A' ' 12' ' ' MET . 87.1 mtt180 -65.5 -28.42 69.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.122 0.487 . . . . 0.0 110.142 176.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.418 ' CE1' ' HD2' ' A' ' 48' ' ' LYS . 49.9 t80 -69.26 -20.57 63.93 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.461 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 46.4 m95 -103.63 -28.64 11.59 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.524 -175.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.71 ' HE1' ' HA ' ' A' ' 37' ' ' ARG . 47.9 mtm -55.56 -41.5 73.37 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.178 0.514 . . . . 0.0 110.207 178.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.605 ' HB ' ' HB3' ' A' ' 5' ' ' ALA . 3.4 p -89.91 123.08 41.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 169.5 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -58.86 143.8 46.41 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-O 121.68 0.752 . . . . 0.0 110.671 -176.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -75.37 98.29 3.82 Favored 'General case' 0 N--CA 1.436 -1.129 0 CA-C-N 114.667 -1.151 . . . . 0.0 113.594 -163.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -106.0 95.97 11.99 Favored Pre-proline 0 C--N 1.317 -0.818 0 N-CA-C 106.868 -1.531 . . . . 0.0 106.868 158.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.845 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 25.9 Cg_exo -62.68 -37.37 57.45 Favored 'Trans proline' 0 N--CA 1.449 -1.147 0 C-N-CA 121.997 1.798 . . . . 0.0 111.997 -173.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.485 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -61.4 -38.75 88.22 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.228 -179.822 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 48.4 t90 -69.25 -38.34 78.41 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-O 120.875 0.369 . . . . 0.0 110.038 173.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.418 ' HD2' ' CE1' ' A' ' 38' ' ' TYR . 23.4 mmtp -60.6 -33.36 72.62 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.363 177.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.845 ' HG3' ' O ' ' A' ' 45' ' ' PRO . 31.7 mtpt -82.54 -38.44 23.74 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.236 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 42.9 mt-10 -61.84 -39.02 90.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.285 0.564 . . . . 0.0 111.271 176.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.603 ' HE3' ' HG3' ' A' ' 6' ' ' GLU . 17.6 ptm -78.79 -26.96 44.45 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-O 121.217 0.532 . . . . 0.0 109.767 -178.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.505 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 33.7 t80 -71.36 -39.28 71.39 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.155 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -74.39 -22.16 59.31 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.546 0.689 . . . . 0.0 109.464 177.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.7 tptm -71.09 -37.51 72.42 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.49 172.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -68.16 -25.84 65.46 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.628 178.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 58.7 mt -86.43 -32.53 20.82 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.309 178.602 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -89.91 -49.21 6.74 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.131 0.491 . . . . 0.0 110.961 -177.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -86.36 -56.29 3.51 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.74 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 . . . . . 0 C--O 1.247 0.935 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.575 -179.522 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.662 0 N-CA-C 112.134 -0.386 . . . . 0.0 112.134 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.65 40.94 1.14 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.928 0.394 . . . . 0.0 111.002 -177.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 29.6 ttp -74.92 -46.31 36.7 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.12 0.486 . . . . 0.0 110.081 -179.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -66.37 -44.51 82.93 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.846 178.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.424 ' HB2' ' HB ' ' A' ' 41' ' ' VAL . . . -60.03 -42.15 93.76 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.582 176.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -57.97 -46.71 84.7 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.798 177.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.465 ' HE2' ' HA ' ' A' ' 7' ' ' LYS . 5.8 mmpt? -48.72 -57.7 5.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.341 179.298 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.474 ' O ' ' HG2' ' A' ' 12' ' ' MET . 28.2 mt-10 -73.4 -29.85 62.87 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.53 -178.337 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.586 ' HE2' ' HE2' ' A' ' 48' ' ' LYS . 0.4 OUTLIER -58.98 -40.62 85.36 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 177.81 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.53 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 33.4 mm -71.56 -37.08 62.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.339 0.59 . . . . 0.0 110.354 177.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 23.1 m -64.2 -40.8 96.82 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.301 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.474 ' HG2' ' O ' ' A' ' 8' ' ' GLU . 16.4 ptm -75.68 -23.63 56.23 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -177.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 9' ' ' PHE . 85.2 mt -68.77 -39.89 79.98 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.628 174.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.53 ' HD3' ' O ' ' A' ' 10' ' ' ILE . 0.1 OUTLIER -71.56 -39.78 70.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.394 0.616 . . . . 0.0 110.422 177.126 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -75.45 -14.17 60.42 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.597 -0.729 . . . . 0.0 112.546 -175.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.433 HD21 ' HA ' ' A' ' 16' ' ' ASN . 0.8 OUTLIER -107.87 20.18 19.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.834 0.35 . . . . 0.0 110.928 176.274 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 59.79 31.64 20.91 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.339 175.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.501 HG22 ' CE2' ' A' ' 22' ' ' TRP . 51.6 t -78.15 128.85 38.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.029 0.442 . . . . 0.0 111.264 -177.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -150.34 -157.46 0.82 Allowed 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 171.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.8 m -65.46 -9.02 22.07 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.5 p -79.06 -16.92 56.11 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 121.019 0.438 . . . . 0.0 111.199 176.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.597 ' CE2' ' HD3' ' A' ' 26' ' ' ARG . 7.2 m95 -86.86 119.69 27.35 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.281 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.413 ' C ' ' H ' ' A' ' 25' ' ' SER . 5.5 m -83.93 165.49 18.64 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 168.574 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.552 ' CD1' HD13 ' A' ' 27' ' ' ILE . 29.3 t80 -82.46 16.48 2.08 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 122.454 1.121 . . . . 0.0 109.577 -175.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.413 ' H ' ' C ' ' A' ' 23' ' ' SER . 48.1 t -91.4 -31.59 15.97 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-N 113.673 -1.603 . . . . 0.0 107.452 172.165 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.597 ' HD3' ' CE2' ' A' ' 22' ' ' TRP . 28.7 ttt180 -75.05 -33.32 61.71 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.846 179.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.552 HD13 ' CD1' ' A' ' 24' ' ' PHE . 54.2 mt -66.15 -42.3 90.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.175 176.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.6 mt -74.58 -43.36 48.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 119.561 -0.855 . . . . 0.0 111.808 175.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.2 t -82.4 -38.87 23.47 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -169.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.799 ' O ' ' HB2' ' A' ' 34' ' ' ARG . 28.9 mm-40 -103.89 -35.77 8.03 Favored 'General case' 0 C--O 1.212 -0.902 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.319 -176.701 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.533 HD21 HG22 ' A' ' 27' ' ' ILE . 8.9 tp -87.57 -36.27 17.64 Favored 'General case' 0 C--N 1.315 -0.91 0 O-C-N 123.569 0.543 . . . . 0.0 111.153 -167.049 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.48 -49.35 79.55 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.297 177.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 68.8 p -83.41 -10.08 58.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.048 0.451 . . . . 0.0 111.64 -177.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.799 ' HB2' ' O ' ' A' ' 30' ' ' GLU . 53.2 ttm-85 -83.31 -45.16 14.1 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.051 -177.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.423 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 8.0 t70 -138.09 128.23 15.24 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.583 -176.36 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 20.6 Cg_exo -66.87 -13.06 38.48 Favored 'Trans proline' 0 N--CA 1.465 -0.168 0 C-N-CA 123.517 2.811 . . . . 0.0 113.269 -178.058 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.487 ' HA ' ' HB2' ' A' ' 40' ' ' MET . 79.7 mtm180 -64.54 -19.45 65.63 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -70.3 -24.44 63.02 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 121.082 0.467 . . . . 0.0 109.881 175.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 53.9 m95 -101.6 -18.86 15.71 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.768 -178.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.487 ' HB2' ' HA ' ' A' ' 37' ' ' ARG . 18.3 ttp -52.55 -46.51 66.82 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 121.407 0.622 . . . . 0.0 109.778 175.117 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.424 ' HB ' ' HB2' ' A' ' 5' ' ' ALA . 7.6 p -89.19 133.97 29.83 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 168.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.4 143.01 50.95 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-O 121.334 0.588 . . . . 0.0 109.829 177.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -82.53 97.52 8.48 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.892 -165.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -103.26 101.41 22.29 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 114.691 -1.14 . . . . 0.0 108.45 170.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -59.23 -25.56 78.62 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.872 2.382 . . . . 0.0 112.574 -176.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -75.47 -39.3 58.87 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 47.1 t90 -75.52 -38.38 59.44 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.567 176.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.586 ' HE2' ' HE2' ' A' ' 9' ' ' PHE . 2.8 mptm? -62.66 -33.23 74.62 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 176.309 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.409 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 24.9 mttm -75.73 -41.43 53.39 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 120.975 -0.29 . . . . 0.0 110.833 176.242 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -61.55 -48.15 82.32 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.226 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.435 ' HB2' ' HE1' ' A' ' 51' ' ' MET . 3.5 ppp? -75.28 -27.69 59.49 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.787 -174.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.607 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 35.3 t80 -74.59 -38.97 62.47 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.678 178.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 49' ' ' LYS . 45.2 mt-10 -73.0 -23.05 60.59 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 176.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 31.8 tptt -73.22 -38.45 66.06 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.522 0.677 . . . . 0.0 109.456 172.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.7 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 61.7 t80 -71.75 -23.06 61.54 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.666 -177.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 56.3 mt -89.5 -33.8 16.64 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.961 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -95.72 -53.32 3.75 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.887 0.375 . . . . 0.0 110.805 -176.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -75.11 -53.38 8.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.018 178.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.7 ' HG2' ' O ' ' A' ' 55' ' ' TYR . 77.1 mtt180 . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.438 -178.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.491 0 N-CA-C 111.603 -0.599 . . . . 0.0 111.603 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.761 ' HB2' ' HB1' ' A' ' 5' ' ' ALA . . . -101.45 97.16 7.66 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.754 0.311 . . . . 0.0 110.519 -177.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 83.1 mtp -92.61 -63.38 1.23 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.025 0.44 . . . . 0.0 109.952 179.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.582 ' O ' ' HG3' ' A' ' 8' ' ' GLU . 23.1 mt-10 -64.1 -40.59 96.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.941 176.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.761 ' HB1' ' HB2' ' A' ' 2' ' ' ALA . . . -63.22 -35.69 81.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.685 -178.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.529 ' O ' HG12 ' A' ' 10' ' ' ILE . 32.6 tt0 -58.8 -51.26 70.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.352 0.596 . . . . 0.0 109.849 174.271 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.432 ' HE2' ' HB3' ' A' ' 7' ' ' LYS . 51.1 mtpt -63.03 -39.33 94.44 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.012 -179.099 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.582 ' HG3' ' O ' ' A' ' 4' ' ' GLU . 42.5 mt-10 -63.36 -40.23 96.69 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 120.904 0.383 . . . . 0.0 110.066 176.076 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.449 ' HA ' ' HG2' ' A' ' 12' ' ' MET . 48.2 t80 -60.75 -37.83 83.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.104 176.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.606 ' O ' ' HD2' ' A' ' 14' ' ' LYS . 41.0 mm -71.81 -37.08 60.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.387 178.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.6 m -66.67 -40.55 88.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.486 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.492 ' SD ' ' HB3' ' A' ' 37' ' ' ARG . 24.3 ptm -73.41 -22.24 60.28 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.477 HD23 ' HG3' ' A' ' 12' ' ' MET . 0.1 OUTLIER -70.45 -37.83 74.39 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.335 176.563 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.606 ' HD2' ' O ' ' A' ' 10' ' ' ILE . 3.8 mptt -68.16 -37.71 81.3 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.321 0.582 . . . . 0.0 109.847 173.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -66.21 -36.78 83.94 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.95 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -88.95 10.12 22.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.056 -179.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 61.71 31.79 18.48 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.37 176.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.45 HG13 HD12 ' A' ' 13' ' ' LEU . 40.2 t -75.75 139.47 18.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.682 0.277 . . . . 0.0 110.871 -177.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.458 ' OD1' HG22 ' A' ' 21' ' ' THR . 4.5 p-10 -156.4 -161.02 1.05 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.023 175.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.661 ' HA ' HD23 ' A' ' 56' ' ' LEU . 69.3 m -60.39 -30.52 69.64 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -175.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.458 HG22 ' OD1' ' A' ' 19' ' ' ASP . 13.2 t -81.19 11.31 4.34 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.991 0.424 . . . . 0.0 111.935 -175.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.512 ' CZ3' HD13 ' A' ' 31' ' ' LEU . 5.3 m95 -96.67 138.87 33.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.201 0.525 . . . . 0.0 111.56 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -97.03 154.85 17.07 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 171.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.435 ' HD1' HD12 ' A' ' 27' ' ' ILE . 67.2 t80 -86.19 14.96 5.62 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 122.196 0.998 . . . . 0.0 110.358 -175.303 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.0 m -93.31 -33.31 13.96 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 114.315 -1.311 . . . . 0.0 107.581 168.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -70.13 -36.91 75.12 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 114.05 -1.432 . . . . 0.0 109.512 176.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.715 HG23 HD21 ' A' ' 31' ' ' LEU . 28.4 mt -61.1 -54.95 28.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.244 173.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 68.4 mt -61.55 -37.1 77.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 120.022 -0.671 . . . . 0.0 111.459 179.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.8 t -79.29 -40.94 29.21 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -173.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -99.86 -34.14 10.26 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.851 -175.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.715 HD21 HG23 ' A' ' 27' ' ' ILE . 4.2 mp -84.47 -23.51 29.86 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 -176.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -76.45 -13.34 83.51 Favored Glycine 0 N--CA 1.444 -0.814 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.588 174.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.4 p -114.58 -45.94 2.98 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 -176.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 90.1 mtt-85 -56.38 -44.69 80.46 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -177.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.421 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 9.7 t70 -145.91 130.64 8.93 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-O 120.829 0.347 . . . . 0.0 111.067 -173.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 24.5 Cg_exo -64.66 -4.99 9.39 Favored 'Trans proline' 0 CA--C 1.531 0.375 0 C-N-CA 123.6 2.866 . . . . 0.0 113.744 -178.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.492 ' HB3' ' SD ' ' A' ' 12' ' ' MET . 13.3 mtm180 -55.28 -28.64 54.82 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 176.074 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 70.9 t80 -68.64 -20.21 64.46 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.001 0.429 . . . . 0.0 110.133 178.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 58.7 m95 -107.05 -21.95 12.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.241 -177.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 85.0 mtp -58.17 -42.48 86.13 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.442 0.639 . . . . 0.0 109.341 174.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.644 ' HB ' ' HB3' ' A' ' 5' ' ' ALA . 6.7 p -86.21 132.01 33.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.328 -0.851 . . . . 0.0 108.842 169.403 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.19 143.58 48.54 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-O 121.482 0.658 . . . . 0.0 110.282 179.176 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -94.03 97.71 10.51 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.385 -166.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -105.88 97.83 16.39 Favored Pre-proline 0 N--CA 1.442 -0.862 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 163.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.591 ' O ' ' HB3' ' A' ' 49' ' ' LYS . 24.2 Cg_exo -63.1 -22.37 73.18 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.65 2.234 . . . . 0.0 112.474 -171.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -74.78 -39.27 61.84 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 177.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . 0.415 ' O ' ' HG2' ' A' ' 51' ' ' MET . 45.3 t90 -72.93 -38.36 66.86 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 173.378 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.55 ' HB2' ' HA ' ' A' ' 45' ' ' PRO . 24.8 mmtp -59.78 -33.66 71.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.185 177.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.591 ' HB3' ' O ' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -87.07 -32.82 19.75 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.509 -178.657 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -67.14 -39.55 86.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.048 0.451 . . . . 0.0 111.131 176.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.42 ' HE1' ' HG3' ' A' ' 6' ' ' GLU . 16.9 ptm -74.79 -26.39 59.71 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.653 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 32.4 t80 -69.37 -36.06 76.45 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.209 173.007 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 49' ' ' LYS . 38.0 mm-40 -65.13 -31.95 73.4 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.248 0.547 . . . . 0.0 109.651 175.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -72.99 -38.6 66.59 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.99 177.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.401 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 86.1 t80 -70.02 -20.99 63.24 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.084 -177.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.661 HD23 ' HA ' ' A' ' 20' ' ' SER . 87.1 mt -81.75 -33.24 31.12 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.258 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 37.0 p -100.32 -46.45 5.26 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.9 0.381 . . . . 0.0 111.632 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.417 ' O ' ' HB2' ' A' ' 59' ' ' ARG . 6.8 t30 -89.59 -47.65 7.82 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.705 -176.347 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 58' ' ' ASN . 76.3 mtt180 . . . . . 0 C--O 1.251 1.151 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.231 -173.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.9 0 N-CA-C 111.868 -0.493 . . . . 0.0 111.868 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -108.56 61.31 0.6 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.925 0.393 . . . . 0.0 111.641 -176.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 78.5 mtp -106.65 -97.91 0.35 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 173.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -63.03 -30.82 71.9 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.305 0.574 . . . . 0.0 110.041 177.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.576 ' O ' ' HB2' ' A' ' 9' ' ' PHE . . . -56.18 -56.45 20.72 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.691 177.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.424 ' O ' HG12 ' A' ' 10' ' ' ILE . 28.9 tt0 -71.06 -47.12 60.22 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.972 -178.251 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.622 ' O ' ' HE2' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -42.3 -64.1 0.65 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.772 -1.104 . . . . 0.0 111.305 176.45 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.495 ' HB3' ' CD ' ' A' ' 37' ' ' ARG . 56.0 mm-40 -78.41 -16.71 57.32 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.75 -0.38 . . . . 0.0 112.009 -175.054 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.576 ' HB2' ' O ' ' A' ' 5' ' ' ALA . 21.3 t80 -69.5 -40.04 77.25 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 175.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.424 HG12 ' O ' ' A' ' 6' ' ' GLU . 46.0 mm -74.41 -36.31 41.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 121.551 0.691 . . . . 0.0 109.824 178.011 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 19.9 m -66.92 -33.29 75.27 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.607 178.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.505 ' HE3' ' HA ' ' A' ' 9' ' ' PHE . 18.1 ttp -76.57 -32.4 58.12 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.107 179.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.457 HD13 HG11 ' A' ' 18' ' ' VAL . 0.1 OUTLIER -68.43 -38.57 81.3 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.104 179.105 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 14.3 mtpt -68.18 -40.96 82.1 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.012 0.434 . . . . 0.0 110.845 175.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.425 ' CD ' HH22 ' A' ' 37' ' ' ARG . 29.8 mt-10 -67.05 -18.56 65.4 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.078 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -105.05 16.56 25.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.785 178.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 56.28 32.42 20.36 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.527 -0.761 . . . . 0.0 112.682 176.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.457 HG11 HD13 ' A' ' 13' ' ' LEU . 58.1 t -76.41 119.41 24.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.008 0.433 . . . . 0.0 111.288 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -128.58 -156.0 0.73 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.507 172.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.1 p -68.91 -8.72 46.81 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.034 0.445 . . . . 0.0 111.365 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.4 p -79.77 9.66 4.94 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.781 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.671 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 11.7 m95 -117.76 146.2 43.96 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.15 0.5 . . . . 0.0 111.876 -175.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.9 m -110.17 164.93 12.16 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 165.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.672 ' CE1' ' HB3' ' A' ' 48' ' ' LYS . 88.5 t80 -82.99 16.27 2.39 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 122.308 1.051 . . . . 0.0 110.891 -171.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.5 m -92.16 -32.55 15.06 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 113.861 -1.518 . . . . 0.0 107.947 171.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.671 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 42.5 ttt180 -71.07 -35.46 71.9 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.408 -1.269 . . . . 0.0 109.398 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.54 ' O ' ' HB2' ' A' ' 31' ' ' LEU . 54.9 mt -64.62 -54.45 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.867 175.131 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.1 mt -62.23 -40.19 86.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 C-N-CA 119.691 -0.804 . . . . 0.0 111.348 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.6 t -76.96 -39.27 51.22 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -173.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -112.65 -33.28 6.18 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -173.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.54 ' HB2' ' O ' ' A' ' 27' ' ' ILE . 1.6 mp -78.28 -30.27 48.41 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 122.04 -0.413 . . . . 0.0 110.859 -177.089 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.66 -18.61 64.04 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.731 -0.747 . . . . 0.0 111.969 175.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.0 p -112.06 -27.69 8.29 Favored 'General case' 0 C--O 1.234 0.254 0 O-C-N 122.381 -0.481 . . . . 0.0 111.996 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.9 mtm180 -74.67 -30.48 61.6 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -178.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.443 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 7.9 t70 -151.48 128.97 5.67 Favored Pre-proline 0 C--N 1.329 -0.3 0 C-N-CA 120.199 -0.6 . . . . 0.0 111.185 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 16.3 Cg_exo -69.85 -5.34 16.02 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 123.466 2.777 . . . . 0.0 113.825 -178.208 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.495 ' CD ' ' HB3' ' A' ' 8' ' ' GLU . 57.7 mtm180 -60.62 -22.28 63.61 Favored 'General case' 0 C--N 1.333 -0.123 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 176.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 69.1 t80 -68.3 -20.62 64.77 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.899 0.381 . . . . 0.0 110.007 176.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 56.7 m95 -105.25 -17.88 14.31 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.4 -176.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 90.5 mmm -57.65 -37.77 73.94 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.324 0.583 . . . . 0.0 109.87 175.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 6.3 p -96.62 141.3 15.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.455 -0.793 . . . . 0.0 108.886 169.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -59.92 143.7 50.85 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-O 121.616 0.722 . . . . 0.0 109.735 175.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.4 ' HA ' ' HZ1' ' A' ' 48' ' ' LYS . 25.3 t0 -81.56 97.25 7.75 Favored 'General case' 0 C--N 1.301 -1.509 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.089 -171.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -102.05 98.25 9.81 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 170.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -61.41 -30.57 87.31 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.66 2.24 . . . . 0.0 112.699 -173.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.46 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 0.6 OUTLIER -72.53 -40.0 67.1 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.742 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . 0.491 ' O ' ' HG2' ' A' ' 51' ' ' MET . 41.8 t90 -73.79 -38.04 64.76 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-N 116.778 -0.192 . . . . 0.0 110.567 176.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.672 ' HB3' ' CE1' ' A' ' 24' ' ' PHE . 2.5 mptm? -63.37 -33.37 75.38 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.289 177.283 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.406 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 23.7 mttm -73.76 -40.6 63.37 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 120.927 0.394 . . . . 0.0 110.19 176.018 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 42.8 mt-10 -63.23 -44.64 94.68 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.067 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.491 ' HG2' ' O ' ' A' ' 47' ' ' TRP . 13.5 ptm -76.7 -21.61 55.08 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.215 -176.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.4 ' CZ ' HD11 ' A' ' 56' ' ' LEU . 22.5 t80 -76.35 -37.95 56.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.167 176.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 49' ' ' LYS . 37.7 mt-10 -67.56 -30.95 70.72 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 175.402 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.4 tttt -71.85 -37.69 70.2 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.392 175.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -66.85 -23.72 66.06 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.941 0.4 . . . . 0.0 111.039 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.4 HD11 ' CZ ' ' A' ' 52' ' ' PHE . 67.4 mt -98.6 -33.46 10.96 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.6 t -89.48 -23.32 22.12 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.05 0.453 . . . . 0.0 111.233 -177.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -126.41 -53.06 1.48 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.665 -178.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 . . . . . 0 C--O 1.251 1.164 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.585 -179.688 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.69 0 N-CA-C 111.957 -0.457 . . . . 0.0 111.957 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 61.94 35.28 16.33 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-O 121.159 0.504 . . . . 0.0 110.507 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 12.6 tpt -95.65 -45.76 6.9 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.978 -177.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -65.11 -47.7 76.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.726 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.584 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -59.28 -43.36 92.55 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.58 -1.191 . . . . 0.0 111.265 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.577 ' HG3' ' HE2' ' A' ' 51' ' ' MET . 32.1 tt0 -63.78 -49.55 72.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.014 0.435 . . . . 0.0 110.641 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.428 ' HE2' ' HB3' ' A' ' 7' ' ' LYS . 15.1 ttpt -49.73 -51.45 38.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.362 -0.836 . . . . 0.0 112.122 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -71.32 -33.55 69.75 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.044 -179.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.622 ' O ' HD21 ' A' ' 13' ' ' LEU . 36.2 t80 -61.68 -38.17 86.83 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.133 0.492 . . . . 0.0 110.113 177.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.499 HG12 ' O ' ' A' ' 6' ' ' GLU . 44.4 mm -71.97 -35.91 55.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.349 0.595 . . . . 0.0 110.145 177.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 48.4 m -67.94 -41.5 82.45 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.642 -179.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.556 ' SD ' ' HA ' ' A' ' 9' ' ' PHE . 21.7 ptm -70.44 -28.99 65.46 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -179.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.622 HD21 ' O ' ' A' ' 9' ' ' PHE . 1.8 mm? -68.46 -37.4 80.15 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.022 177.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.6 mttt -69.73 -38.51 76.91 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.925 175.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -68.28 -27.5 66.38 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.768 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.572 ' ND2' ' HG ' ' A' ' 31' ' ' LEU . 94.3 m-20 -90.82 9.5 29.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.216 -179.151 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 57.48 31.35 20.11 Favored 'General case' 0 CA--C 1.526 0.046 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.267 176.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.576 HG21 HD13 ' A' ' 13' ' ' LEU . 66.3 t -74.1 129.45 36.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.605 -175.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -120.57 -162.58 0.95 Allowed 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 170.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.6 p -77.24 -6.45 53.11 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.899 0.38 . . . . 0.0 111.693 -178.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.5 p -81.8 -13.48 57.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.904 0.383 . . . . 0.0 111.459 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.511 ' CZ3' HD13 ' A' ' 31' ' ' LEU . 6.1 m95 -74.2 136.02 42.78 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.704 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.8 t -90.25 156.66 18.14 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 169.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.52 ' CZ ' ' HB3' ' A' ' 48' ' ' LYS . 42.1 t80 -83.49 16.68 2.48 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 122.123 0.963 . . . . 0.0 109.513 -177.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 27.4 t -93.1 -41.7 9.8 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.135 -1.393 . . . . 0.0 107.611 171.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.508 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 54.2 ttt180 -65.25 -34.29 78.02 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.092 -1.413 . . . . 0.0 109.506 176.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.707 HG22 HD21 ' A' ' 31' ' ' LEU . 59.6 mt -62.99 -56.76 15.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.153 174.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 24' ' ' PHE . 40.1 mm -59.59 -38.46 75.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 120.583 -0.447 . . . . 0.0 111.644 179.125 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.8 t -82.16 -38.81 24.13 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -171.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.535 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 8.3 mm-40 -100.55 -35.26 9.58 Favored 'General case' 0 C--O 1.217 -0.657 0 C-N-CA 120.462 -0.495 . . . . 0.0 111.429 -176.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.707 HD21 HG22 ' A' ' 27' ' ' ILE . 4.6 mp -82.19 -20.14 38.42 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -177.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -79.42 -6.79 88.85 Favored Glycine 0 N--CA 1.44 -1.056 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.571 173.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 38.8 p -125.84 -29.16 3.14 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -176.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.535 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 41.5 mtt180 -56.85 -52.14 66.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.635 0.255 . . . . 0.0 111.085 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.459 ' OD1' ' HB2' ' A' ' 37' ' ' ARG . 1.8 p30 -154.93 148.96 19.04 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.297 178.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.43 ' O ' ' HG2' ' A' ' 40' ' ' MET . 20.5 Cg_exo -66.74 4.5 1.06 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.682 2.922 . . . . 0.0 114.295 -174.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.459 ' HB2' ' OD1' ' A' ' 35' ' ' ASP . 54.3 mtm180 -59.21 -34.92 72.73 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 117.77 0.259 . . . . 0.0 111.599 178.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -69.2 -17.26 63.77 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 120.899 0.38 . . . . 0.0 110.173 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -102.2 -19.25 15.16 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.725 -179.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.43 ' HG2' ' O ' ' A' ' 36' ' ' PRO . 95.7 mmm -64.11 -51.88 61.86 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 172.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.584 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 2.6 p -86.58 114.16 25.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.144 -0.934 . . . . 0.0 109.066 171.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -58.4 145.6 37.8 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 122.184 0.993 . . . . 0.0 111.709 -172.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.724 ' HA ' ' HZ1' ' A' ' 48' ' ' LYS . 10.7 p-10 -78.67 96.9 5.65 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 114.081 -1.418 . . . . 0.0 112.071 -170.353 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -104.14 99.59 17.64 Favored Pre-proline 0 C--N 1.32 -0.704 0 N-CA-C 107.551 -1.278 . . . . 0.0 107.551 165.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -62.47 -24.73 75.59 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 122.354 2.036 . . . . 0.0 113.098 -172.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.423 ' HA ' HD23 ' A' ' 46' ' ' LEU . 0.6 OUTLIER -80.62 -39.53 27.3 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 -179.19 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . 0.499 ' O ' ' HG2' ' A' ' 51' ' ' MET . 44.4 t90 -74.76 -37.83 62.37 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.403 175.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.724 ' HZ1' ' HA ' ' A' ' 43' ' ' ASP . 1.2 mptm? -61.99 -32.27 72.72 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.256 -0.275 . . . . 0.0 110.256 177.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 36.3 mttt -77.62 -39.4 45.51 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 120.841 0.353 . . . . 0.0 110.711 175.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -64.11 -40.08 95.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.037 0.446 . . . . 0.0 111.266 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.577 ' HE2' ' HG3' ' A' ' 6' ' ' GLU . 12.7 ptm -79.13 -21.33 46.7 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.544 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 22.3 t80 -69.9 -37.15 75.91 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.514 -0.551 . . . . 0.0 109.514 173.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -67.01 -30.91 71.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.133 173.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.437 ' HE2' ' OD1' ' A' ' 58' ' ' ASN . 13.7 tptm -71.72 -38.32 70.51 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.253 176.018 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.432 ' O ' ' HA ' ' A' ' 59' ' ' ARG . 32.4 t80 -65.79 -34.13 77.45 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.602 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 76.0 mt -79.24 -32.04 43.73 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 120.943 -0.303 . . . . 0.0 111.511 -179.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.1 p -87.08 -64.0 1.22 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.888 0.375 . . . . 0.0 111.692 178.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.51 ' O ' ' HB2' ' A' ' 59' ' ' ARG . 0.2 OUTLIER -70.45 -47.92 58.36 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.275 -178.214 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.51 ' HB2' ' O ' ' A' ' 58' ' ' ASN . 21.6 mmt180 . . . . . 0 C--O 1.246 0.887 0 O-C-N 123.988 0.805 . . . . 0.0 110.723 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.794 0 N-CA-C 111.996 -0.442 . . . . 0.0 111.996 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.92 8.31 7.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.928 0.394 . . . . 0.0 111.459 -179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 38.4 ttp -87.32 -54.07 4.49 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.308 0.575 . . . . 0.0 109.515 177.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -62.18 -46.1 90.46 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.087 177.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.571 ' CB ' ' HB ' ' A' ' 41' ' ' VAL . . . -63.97 -29.68 70.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.979 -1.009 . . . . 0.0 111.315 -179.434 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.49 ' O ' HG12 ' A' ' 10' ' ' ILE . 12.9 tt0 -60.81 -56.62 19.09 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.417 0.627 . . . . 0.0 110.3 177.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.507 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -58.32 -42.57 87.05 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.806 -1.088 . . . . 0.0 111.374 -178.545 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -62.14 -38.59 89.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.203 0.525 . . . . 0.0 110.478 176.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.531 ' HA ' ' HE2' ' A' ' 12' ' ' MET . 14.6 t80 -64.84 -39.58 93.8 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.084 178.502 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.49 HG12 ' O ' ' A' ' 6' ' ' GLU . 48.1 mm -70.75 -37.77 70.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.138 0.494 . . . . 0.0 110.542 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 35.1 m -68.65 -31.71 71.04 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.332 176.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.531 ' HE2' ' HA ' ' A' ' 9' ' ' PHE . 37.8 ttp -71.78 -33.29 68.47 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 177.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.639 HD23 HD22 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -71.02 -39.84 72.13 Favored 'General case' 0 N--CA 1.439 -0.977 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.935 178.903 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.0 mtpp -64.67 -35.42 80.98 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.178 0.513 . . . . 0.0 110.611 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.487 ' CD ' HH22 ' A' ' 37' ' ' ARG . 29.7 mt-10 -70.63 -22.84 62.48 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.018 178.466 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -101.98 7.19 41.43 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.415 176.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 6.8 mm100 56.76 31.11 18.86 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 173.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.613 HG12 HD11 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -67.32 143.89 15.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.658 0.742 . . . . 0.0 111.274 -179.969 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.55 ' CG ' ' H ' ' A' ' 20' ' ' SER . 0.0 OUTLIER -148.25 -174.22 4.52 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.848 179.012 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.55 ' H ' ' CG ' ' A' ' 19' ' ' ASP . 4.3 p -58.02 -23.15 53.01 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 120.857 0.36 . . . . 0.0 111.754 -175.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.2 p -77.45 -1.4 30.11 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.706 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 4.3 m95 -84.94 144.96 28.0 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.927 0.394 . . . . 0.0 110.398 174.435 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.8 p -102.88 165.78 10.84 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 172.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.499 ' CD1' HD12 ' A' ' 27' ' ' ILE . 30.2 t80 -87.21 15.87 5.8 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 122.48 1.133 . . . . 0.0 108.553 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.2 t -91.43 -38.78 12.36 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 106.633 -1.618 . . . . 0.0 106.633 168.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.706 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 36.9 ttt180 -67.44 -34.5 77.33 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.595 176.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.722 HG21 HD23 ' A' ' 31' ' ' LEU . 52.0 mt -66.61 -42.08 89.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.644 178.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.1 mt -78.64 -33.34 16.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 C-N-CA 119.284 -0.966 . . . . 0.0 111.866 176.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.7 p -87.64 -40.58 14.06 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -171.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.643 ' O ' ' HD3' ' A' ' 34' ' ' ARG . 26.2 mm-40 -106.82 -36.56 6.63 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 121.279 0.561 . . . . 0.0 110.219 -176.152 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.722 HD23 HG21 ' A' ' 27' ' ' ILE . 11.5 tp -80.22 -36.17 35.19 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.322 -170.241 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.56 -22.34 76.55 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.087 175.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 35.5 p -101.57 -28.29 12.61 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 122.425 -0.456 . . . . 0.0 111.731 -178.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.643 ' HD3' ' O ' ' A' ' 30' ' ' GLU . 0.5 OUTLIER -63.34 -48.57 77.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.319 179.175 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.48 ' HB3' ' SD ' ' A' ' 12' ' ' MET . 4.8 t70 -139.04 133.92 16.58 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-O 121.056 0.455 . . . . 0.0 111.722 -170.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 17.1 Cg_exo -68.4 -11.81 33.05 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 123.694 2.93 . . . . 0.0 113.158 -179.078 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.487 HH22 ' CD ' ' A' ' 15' ' ' GLU . 72.2 mtm180 -62.16 -20.95 64.65 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 177.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -68.32 -21.71 64.74 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.967 0.413 . . . . 0.0 110.165 176.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.419 ' HD1' ' HA ' ' A' ' 36' ' ' PRO . 60.6 m95 -101.86 -17.74 16.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.683 -174.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.462 ' HG2' ' HA ' ' A' ' 37' ' ' ARG . 96.7 mmm -55.49 -37.16 67.46 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.234 0.54 . . . . 0.0 110.371 178.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.571 ' HB ' ' CB ' ' A' ' 5' ' ' ALA . 6.8 p -99.01 134.4 38.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 171.031 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -59.75 142.34 53.43 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-O 121.486 0.66 . . . . 0.0 109.875 177.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -78.8 98.83 6.45 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.008 -0.997 . . . . 0.0 112.547 -163.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -103.65 101.12 22.18 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 114.817 -1.083 . . . . 0.0 108.449 169.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -63.0 -26.61 73.94 Favored 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.855 2.37 . . . . 0.0 112.53 -175.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.536 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 1.1 tm? -75.75 -39.05 57.8 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . 0.489 ' O ' ' HG2' ' A' ' 51' ' ' MET . 45.4 t90 -74.53 -37.06 63.16 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.691 176.246 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.528 ' HG3' ' CZ ' ' A' ' 9' ' ' PHE . 2.3 mptm? -62.07 -32.46 73.0 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.593 -0.443 . . . . 0.0 109.978 175.452 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.536 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 26.9 mttm -72.69 -40.86 65.9 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 120.916 0.388 . . . . 0.0 110.31 174.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.536 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 26.5 mt-10 -66.15 -41.88 89.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.309 -178.303 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.489 ' HG2' ' O ' ' A' ' 47' ' ' TRP . 12.5 ptm -76.35 -22.05 55.36 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.86 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.493 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 28.2 t80 -75.26 -37.61 60.87 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.134 -0.484 . . . . 0.0 109.721 175.08 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.536 ' HG2' ' O ' ' A' ' 49' ' ' LYS . 79.0 mm-40 -66.35 -29.1 69.21 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 121.199 0.524 . . . . 0.0 109.634 174.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -72.53 -38.43 68.02 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.979 174.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.552 ' HE2' HG23 ' A' ' 18' ' ' VAL . 53.6 t80 -70.72 -23.08 62.38 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.621 -178.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 60.7 mt -93.54 -33.25 13.82 Favored 'General case' 0 N--CA 1.441 -0.896 0 C-N-CA 120.646 -0.422 . . . . 0.0 111.795 179.348 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 45.4 t -87.63 -32.44 19.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.8 0.333 . . . . 0.0 111.103 -178.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -109.45 -58.61 2.02 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.326 -0.397 . . . . 0.0 109.997 -178.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.8 ttm180 . . . . . 0 C--O 1.251 1.171 0 O-C-N 124.254 0.971 . . . . 0.0 110.256 -178.333 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.898 0 N-CA-C 112.037 -0.425 . . . . 0.0 112.037 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -83.19 18.14 1.82 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.95 0.405 . . . . 0.0 111.731 -176.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 69.3 mtm -105.53 -66.94 0.95 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.23 0.538 . . . . 0.0 109.737 176.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -65.26 -50.85 64.21 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.952 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -61.67 -29.76 70.29 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.935 -178.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -63.14 -54.12 42.7 Favored 'General case' 0 CA--C 1.509 -0.596 0 CA-C-O 121.354 0.597 . . . . 0.0 110.0 177.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.4 ' HA ' ' HD3' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -54.87 -45.64 74.64 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.668 -1.151 . . . . 0.0 111.815 -179.263 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.536 ' O ' ' HG2' ' A' ' 12' ' ' MET . 53.2 mm-40 -68.13 -35.41 78.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.586 0.232 . . . . 0.0 111.228 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.566 ' CZ ' ' HG3' ' A' ' 48' ' ' LYS . 12.6 t80 -64.22 -38.46 91.11 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.759 177.316 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.653 HG12 ' HE2' ' A' ' 51' ' ' MET . 24.4 mm -65.53 -37.44 80.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.572 0.701 . . . . 0.0 109.82 173.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.644 ' HA ' ' CE ' ' A' ' 14' ' ' LYS . 32.7 m -69.17 -41.39 77.29 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.546 -178.138 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.602 ' HE1' ' HB2' ' A' ' 38' ' ' TYR . 15.8 ptm -73.2 -33.52 65.43 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 -179.548 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.483 HD11 HG23 ' A' ' 18' ' ' VAL . 1.7 mm? -68.51 -38.03 80.57 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.578 179.23 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.644 ' CE ' ' HA ' ' A' ' 11' ' ' THR . 0.0 OUTLIER -83.38 -24.18 32.11 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.817 -178.052 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -72.71 -34.57 67.21 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 120.996 0.426 . . . . 0.0 110.87 172.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.462 ' OD1' ' HG ' ' A' ' 31' ' ' LEU . 1.0 OUTLIER -79.3 10.16 3.96 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.987 179.953 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 55.06 31.67 16.67 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.225 177.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.483 HG23 HD11 ' A' ' 13' ' ' LEU . 53.2 t -75.17 150.14 6.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.602 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.439 ' CG ' ' H ' ' A' ' 20' ' ' SER . 6.9 t70 -168.71 -154.7 0.14 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 171.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.439 ' H ' ' CG ' ' A' ' 19' ' ' ASP . 12.3 m -59.69 -27.15 66.17 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -171.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.4 p -83.91 34.77 0.5 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.439 0.638 . . . . 0.0 111.687 -177.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.653 ' CE3' ' HB3' ' A' ' 26' ' ' ARG . 8.9 m95 -133.88 148.35 51.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.044 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 21.7 m -114.01 169.99 8.61 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 169.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.496 ' CZ ' ' HB3' ' A' ' 48' ' ' LYS . 42.6 t80 -83.89 16.75 2.65 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 122.03 0.919 . . . . 0.0 110.875 -170.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.4 m -93.29 -43.93 8.56 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.096 -1.411 . . . . 0.0 107.995 172.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.653 ' HB3' ' CE3' ' A' ' 22' ' ' TRP . 11.8 ttt180 -59.4 -36.35 75.66 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.52 176.295 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.643 ' O ' ' HB2' ' A' ' 31' ' ' LEU . 65.7 mt -64.48 -58.78 5.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.73 177.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.2 mt -62.92 -41.31 92.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 119.898 -0.721 . . . . 0.0 111.641 -178.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.2 m -78.0 -36.91 48.29 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -175.072 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.568 ' HB2' ' O ' ' A' ' 26' ' ' ARG . 48.1 mm-40 -98.17 -36.82 9.93 Favored 'General case' 0 C--O 1.221 -0.436 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -178.234 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.643 ' HB2' ' O ' ' A' ' 27' ' ' ILE . 5.3 mp -83.96 -28.44 27.78 Favored 'General case' 0 CA--C 1.508 -0.637 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.372 -171.336 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.19 -20.24 66.99 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.563 -0.827 . . . . 0.0 111.472 175.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.7 p -108.46 -33.79 6.96 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 178.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 39.9 mtt180 -58.89 -51.29 70.67 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 120.596 0.236 . . . . 0.0 111.141 178.16 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.406 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 6.2 t70 -139.55 129.38 14.13 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-O 121.042 0.449 . . . . 0.0 111.042 -172.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 17.1 Cg_exo -68.76 -8.29 22.95 Favored 'Trans proline' 0 CA--C 1.528 0.183 0 C-N-CA 123.539 2.826 . . . . 0.0 113.036 -178.525 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.612 ' HA ' ' HG3' ' A' ' 40' ' ' MET . 66.1 mtm180 -62.59 -21.57 65.72 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 178.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.602 ' HB2' ' HE1' ' A' ' 12' ' ' MET . 63.9 t80 -66.53 -20.08 65.94 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 177.176 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.403 ' HD1' ' HA ' ' A' ' 36' ' ' PRO . 60.5 m95 -97.89 -18.05 18.92 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.443 -0.799 . . . . 0.0 112.082 -174.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.612 ' HG3' ' HA ' ' A' ' 37' ' ' ARG . 42.8 mtm -55.63 -49.24 73.37 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.614 0.721 . . . . 0.0 109.605 177.312 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.417 HG21 ' CZ3' ' A' ' 47' ' ' TRP . 4.2 p -99.28 122.67 51.33 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 CA-C-N 114.964 -1.017 . . . . 0.0 108.984 172.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -58.36 146.44 34.64 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-O 121.81 0.814 . . . . 0.0 111.166 -174.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.825 ' HA ' ' HZ3' ' A' ' 48' ' ' LYS . 15.1 p-10 -68.87 95.43 0.69 Allowed 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 114.349 -1.296 . . . . 0.0 112.104 -168.695 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -102.31 100.44 15.59 Favored Pre-proline 0 N--CA 1.444 -0.738 0 CA-C-N 114.367 -1.288 . . . . 0.0 107.752 169.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -60.81 -29.69 88.71 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 122.209 1.939 . . . . 0.0 112.325 -173.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.463 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 2.6 tm? -73.37 -39.94 64.75 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -178.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . 0.417 ' CZ3' HG21 ' A' ' 41' ' ' VAL . 42.3 t90 -77.77 -37.56 48.73 Favored 'General case' 0 C--O 1.222 -0.343 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.611 177.222 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.825 ' HZ3' ' HA ' ' A' ' 43' ' ' ASP . 1.4 mptm? -62.38 -31.73 72.44 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 177.26 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.4 mttt -77.92 -40.12 40.67 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.69 0.281 . . . . 0.0 111.019 175.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.463 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 27.0 mt-10 -61.86 -46.1 90.9 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.441 0.639 . . . . 0.0 110.664 179.17 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.653 ' HE2' HG12 ' A' ' 10' ' ' ILE . 0.7 OUTLIER -71.85 -33.37 68.38 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.712 -177.927 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.447 ' CZ ' HD11 ' A' ' 56' ' ' LEU . 26.1 t80 -70.44 -38.3 74.49 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.513 -178.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 50' ' ' GLU . 11.6 pt-20 -72.28 -22.93 61.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.4 0.619 . . . . 0.0 109.818 178.233 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.687 ' HG2' ' HB2' ' A' ' 58' ' ' ASN . 2.7 tmmm? -72.5 -37.15 68.49 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.278 171.051 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.634 ' OH ' ' HA ' ' A' ' 14' ' ' LYS . 54.9 t80 -66.44 -21.95 66.21 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.961 0.41 . . . . 0.0 110.318 176.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.447 HD11 ' CZ ' ' A' ' 52' ' ' PHE . 60.8 mt -95.37 -35.33 11.8 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 178.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 44.0 t -88.57 -55.43 3.72 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.12 0.486 . . . . 0.0 110.579 -178.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.687 ' HB2' ' HG2' ' A' ' 54' ' ' LYS . 5.6 m120 -77.02 -51.62 10.77 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.348 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 59' ' ' ARG . 48.7 mtt180 . . . . . 0 C--O 1.248 0.992 0 O-C-N 123.936 0.773 . . . . 0.0 110.629 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.411 ' HB2' ' OE1' ' A' ' 4' ' ' GLU . 69.5 mtm . . . . . 0 C--O 1.234 0.26 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.411 ' OE1' ' HB2' ' A' ' 3' ' ' MET . 1.8 mp0 -61.25 -46.52 90.05 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.5 0.667 . . . . 0.0 110.522 -178.49 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.536 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -59.33 -47.36 85.71 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 114.479 -1.237 . . . . 0.0 111.577 -179.295 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -63.33 -47.18 83.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.997 0.427 . . . . 0.0 110.895 -178.123 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -52.31 -54.22 34.24 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.066 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -64.72 -36.46 84.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.273 178.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.629 ' O ' HD23 ' A' ' 13' ' ' LEU . 24.9 t80 -61.41 -37.78 84.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.373 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.7 mm -68.71 -38.65 79.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.131 0.491 . . . . 0.0 110.264 177.067 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.8 m -69.53 -41.67 75.68 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.573 -177.31 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.509 ' SD ' ' HA ' ' A' ' 9' ' ' PHE . 24.1 ptm -69.11 -26.81 65.1 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 -179.674 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.629 HD23 ' O ' ' A' ' 9' ' ' PHE . 1.3 mm? -69.27 -38.31 78.31 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.36 179.038 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -70.89 -42.33 70.13 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.03 0.443 . . . . 0.0 110.531 174.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -69.34 -28.89 66.62 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.169 -176.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.412 HD22 ' N ' ' A' ' 16' ' ' ASN . 0.9 OUTLIER -85.81 8.65 19.2 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.929 0.395 . . . . 0.0 110.09 175.473 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 59.61 32.5 21.6 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 115.265 -0.879 . . . . 0.0 112.616 175.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.514 HG21 HD13 ' A' ' 13' ' ' LEU . 41.5 t -77.43 141.72 15.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.949 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -154.01 -159.71 1.01 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.95 172.369 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.705 ' HA ' HD22 ' A' ' 56' ' ' LEU . 16.9 m -60.25 -27.01 66.89 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -176.384 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 41.5 p -85.3 45.91 1.23 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 121.181 0.515 . . . . 0.0 111.563 -178.692 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.583 ' CE2' ' HD3' ' A' ' 26' ' ' ARG . 5.5 m95 -139.61 146.82 40.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.607 -177.54 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 93.7 p -105.12 170.22 8.0 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 170.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.445 ' CE1' ' HB3' ' A' ' 48' ' ' LYS . 61.4 t80 -85.2 15.37 4.28 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 122.133 0.968 . . . . 0.0 109.454 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.9 t -92.75 -41.02 10.36 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 113.859 -1.519 . . . . 0.0 107.335 172.281 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.583 ' HD3' ' CE2' ' A' ' 22' ' ' TRP . 18.1 ttt180 -65.74 -32.86 74.63 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 114.327 -1.306 . . . . 0.0 109.635 177.417 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.7 HG23 HD22 ' A' ' 31' ' ' LEU . 33.4 mt -63.08 -54.46 33.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.198 174.383 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.5 mt -62.37 -32.71 55.9 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 120.411 -0.515 . . . . 0.0 111.893 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 96.9 p -85.51 -37.89 19.17 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -174.121 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.479 ' HB3' ' HE ' ' A' ' 34' ' ' ARG . 40.0 mm-40 -101.56 -35.75 9.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.902 0.382 . . . . 0.0 111.497 -174.34 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.7 HD22 HG23 ' A' ' 27' ' ' ILE . 5.3 mp -86.43 -16.33 37.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.388 0.613 . . . . 0.0 109.662 -174.432 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -81.05 -3.79 90.62 Favored Glycine 0 N--CA 1.442 -0.933 0 CA-C-N 115.199 -0.909 . . . . 0.0 111.904 177.306 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 41.3 p -129.04 -38.25 1.64 Allowed 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -176.184 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.479 ' HE ' ' HB3' ' A' ' 30' ' ' GLU . 89.9 mtt-85 -54.84 -45.63 74.53 Favored 'General case' 0 C--O 1.232 0.174 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -176.486 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.461 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 2.8 p30 -155.92 138.95 10.75 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 172.429 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.497 ' O ' ' HG3' ' A' ' 40' ' ' MET . 16.7 Cg_exo -68.98 14.45 0.2 Allowed 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 123.457 2.771 . . . . 0.0 114.474 -171.842 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 43.3 mtm180 -63.35 -28.72 70.19 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 122.128 -0.357 . . . . 0.0 111.043 177.314 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -68.02 -17.44 64.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.387 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 56.2 m95 -106.95 -24.37 12.04 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.921 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.497 ' HG3' ' O ' ' A' ' 36' ' ' PRO . 89.2 mtp -56.14 -49.89 72.67 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 174.185 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.536 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 2.9 p -86.25 123.37 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.354 -0.839 . . . . 0.0 108.77 169.358 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -58.58 144.32 43.22 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-O 121.729 0.776 . . . . 0.0 111.275 -174.477 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -73.12 97.32 2.35 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 114.726 -1.124 . . . . 0.0 111.987 -171.124 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -103.05 97.98 10.76 Favored Pre-proline 0 C--N 1.318 -0.766 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 164.313 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.687 ' O ' ' HB3' ' A' ' 49' ' ' LYS . 17.3 Cg_exo -66.74 -22.21 50.23 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.302 2.001 . . . . 0.0 112.417 -172.51 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.414 HD22 ' HA ' ' A' ' 46' ' ' LEU . 0.3 OUTLIER -82.3 -37.82 25.24 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 179.586 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 45.4 t90 -74.68 -38.75 62.32 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.54 175.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.599 ' HG3' ' CZ ' ' A' ' 9' ' ' PHE . 1.4 mptm? -61.18 -32.41 72.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.035 0.445 . . . . 0.0 110.138 176.528 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.687 ' HB3' ' O ' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -88.59 -33.07 17.8 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.763 -176.493 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -62.9 -47.94 81.12 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.378 0.608 . . . . 0.0 110.257 171.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 1.5 ppp? -71.63 -24.12 61.81 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.032 -176.883 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.55 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 20.3 t80 -69.25 -36.45 77.16 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.095 174.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -65.9 -28.22 68.78 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.184 0.516 . . . . 0.0 109.943 174.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 10.1 tttm -72.58 -37.15 68.26 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.408 172.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.493 ' HA ' ' HA ' ' A' ' 59' ' ' ARG . 63.5 t80 -72.39 -18.8 61.7 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.125 0.488 . . . . 0.0 110.983 -179.114 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.705 HD22 ' HA ' ' A' ' 20' ' ' SER . 72.9 mt -92.28 -32.63 14.95 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 120.839 0.352 . . . . 0.0 111.073 176.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.3 t -85.68 -48.99 8.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.964 0.411 . . . . 0.0 110.754 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -102.6 -45.24 5.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.904 -179.005 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.493 ' HA ' ' HA ' ' A' ' 55' ' ' TYR . 40.3 ttm180 . . . . . 0 C--O 1.249 1.03 0 CA-C-O 117.957 -1.021 . . . . 0.0 110.733 178.239 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.54 ' O ' ' HG3' ' A' ' 7' ' ' LYS . 26.6 mmt . . . . . 0 CA--C 1.52 -0.182 0 CA-C-O 120.727 0.299 . . . . 0.0 111.248 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -68.76 -31.69 70.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.003 0.43 . . . . 0.0 109.963 -178.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.655 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -61.65 -44.47 96.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.723 176.781 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -61.45 -47.32 86.24 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 121.076 0.465 . . . . 0.0 110.466 175.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.54 ' HG3' ' O ' ' A' ' 3' ' ' MET . 48.9 mtpt -55.96 -49.48 73.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.405 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -65.04 -31.16 72.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.851 0.358 . . . . 0.0 110.949 178.083 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.48 ' HE2' ' HE2' ' A' ' 48' ' ' LYS . 1.4 t80 -69.84 -40.21 75.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.94 -179.38 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.5 mm -73.5 -37.16 49.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.185 0.517 . . . . 0.0 110.144 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 26.8 m -65.56 -31.97 73.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.402 176.859 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 24.0 ttp -75.06 -33.91 61.76 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 115.322 -0.853 . . . . 0.0 108.944 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.487 HD13 HG11 ' A' ' 18' ' ' VAL . 0.2 OUTLIER -68.85 -38.88 80.07 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.835 -179.017 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.4 mppt? -73.89 -32.55 63.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.871 0.367 . . . . 0.0 110.904 177.849 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -69.2 -20.62 63.98 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.585 176.037 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.408 ' OD1' ' HD3' ' A' ' 34' ' ' ARG . 39.0 m-80 -106.65 17.48 23.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.657 -0.247 . . . . 0.0 111.471 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.1 mm100 53.6 30.98 11.69 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.592 175.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.487 HG11 HD13 ' A' ' 13' ' ' LEU . 58.7 t -68.5 136.84 25.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.742 -177.622 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -148.62 -156.37 0.71 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.8 p -74.37 -15.07 60.94 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.003 -176.081 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.3 t -83.13 -3.45 57.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.412 0.625 . . . . 0.0 110.739 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.56 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 6.0 m95 -92.18 128.32 37.99 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.112 176.121 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 70.8 p -95.71 174.63 6.88 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.49 -0.929 . . . . 0.0 108.49 170.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.529 ' CD1' HD12 ' A' ' 27' ' ' ILE . 27.8 t80 -86.5 15.18 5.74 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.132 178.246 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.8 t -93.23 -33.14 14.09 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 113.897 -1.501 . . . . 0.0 107.211 171.086 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.56 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 31.6 ttt180 -72.58 -33.71 66.94 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.285 176.415 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.574 HG23 HD23 ' A' ' 31' ' ' LEU . 45.8 mt -65.12 -39.13 84.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.509 176.048 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 72.8 mt -76.27 -44.0 36.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 C-N-CA 119.594 -0.842 . . . . 0.0 111.572 173.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 99.0 p -74.38 -38.07 63.26 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -171.02 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.543 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 50.2 mm-40 -109.96 -37.64 5.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.224 0.535 . . . . 0.0 111.226 -177.08 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.574 HD23 HG23 ' A' ' 27' ' ' ILE . 11.6 tp -87.84 -12.78 43.91 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.857 -162.47 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -83.28 -15.68 71.13 Favored Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.47 -0.872 . . . . 0.0 111.719 176.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.4 p -120.28 -26.96 5.34 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.543 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 46.5 mtt180 -57.12 -40.01 76.23 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.618 0.247 . . . . 0.0 111.104 178.815 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.494 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 8.8 t70 -152.58 129.89 5.79 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.412 179.734 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.494 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 22.3 Cg_exo -66.37 -0.89 4.74 Favored 'Trans proline' 0 CA--C 1.531 0.357 0 C-N-CA 123.658 2.905 . . . . 0.0 113.824 -177.843 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.449 ' HE ' ' CG ' ' A' ' 35' ' ' ASP . 68.2 mtm180 -61.36 -21.27 63.88 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 175.534 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -68.07 -18.67 64.74 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.221 0.534 . . . . 0.0 109.795 175.398 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 53.5 m95 -104.35 -17.29 14.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.409 -176.64 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 32.6 tpp -60.84 -38.55 85.86 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 121.243 0.544 . . . . 0.0 109.564 176.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.655 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 7.2 p -93.61 139.36 18.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.123 171.355 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -64.6 145.69 55.79 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-O 121.727 0.775 . . . . 0.0 111.778 -176.429 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -68.39 96.68 0.69 Allowed 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.155 -1.384 . . . . 0.0 112.051 -171.437 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.506 ' O ' ' HD3' ' A' ' 48' ' ' LYS . 9.8 t70 -122.24 98.31 44.43 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 114.877 -1.056 . . . . 0.0 108.623 169.074 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -60.52 -32.49 93.65 Favored 'Trans proline' 0 CA--C 1.516 -0.409 0 C-N-CA 122.937 2.425 . . . . 0.0 112.758 -174.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.68 -38.35 58.77 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.952 -178.036 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' TRP . . . . . 0.542 ' CZ3' HG21 ' A' ' 41' ' ' VAL . 71.2 t90 -73.2 -36.6 66.55 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.896 -0.321 . . . . 0.0 110.147 174.824 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.506 ' HD3' ' O ' ' A' ' 44' ' ' ASP . 2.3 mptm? -61.07 -34.1 74.37 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.717 -0.393 . . . . 0.0 109.944 176.227 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.486 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 33.3 mttt -78.72 -40.66 32.97 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 120.875 0.369 . . . . 0.0 110.59 178.329 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -65.96 -43.41 88.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.414 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 2.8 ppp? -73.28 -29.02 62.44 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 -178.796 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -69.79 -37.95 76.51 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.423 176.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.486 ' HG3' ' O ' ' A' ' 49' ' ' LYS . 92.5 mt-10 -69.6 -26.5 64.48 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 175.258 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 40.8 tptt -72.98 -37.52 67.0 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.224 0.535 . . . . 0.0 109.618 174.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.439 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 80.1 t80 -63.18 -30.4 71.55 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.684 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 64.6 mt -89.97 -32.83 16.62 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.408 179.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.4 t -79.79 -48.71 13.13 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.878 0.37 . . . . 0.0 111.466 -178.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -100.79 -45.76 5.36 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.547 -176.106 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 55' ' ' TYR . 3.1 mmt180 . . . . . 0 C--O 1.249 1.066 0 O-C-N 123.89 0.744 . . . . 0.0 110.751 176.678 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 68.8 mtm . . . . . 0 CA--C 1.521 -0.154 0 CA-C-O 120.495 0.188 . . . . 0.0 110.886 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -57.07 -42.98 81.64 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.402 0.62 . . . . 0.0 109.934 175.553 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.603 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -60.43 -47.29 86.75 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 114.746 -1.115 . . . . 0.0 111.129 178.57 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -59.15 -49.71 76.84 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.107 0.479 . . . . 0.0 110.395 178.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.403 ' HD2' ' HA ' ' A' ' 7' ' ' LYS . 12.9 mmmm -54.54 -44.85 73.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.945 -179.262 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.453 ' HB3' ' HD3' ' A' ' 37' ' ' ARG . 40.9 mt-10 -75.88 -25.53 56.22 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.036 179.421 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -72.31 -39.9 67.9 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.828 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.624 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 39.2 mm -68.57 -38.73 79.52 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.222 0 CA-C-O 121.389 0.614 . . . . 0.0 109.939 177.339 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.0 m -67.62 -29.68 69.06 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.049 176.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 42.7 ttp -77.24 -29.43 54.07 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.334 -178.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.537 HD13 HG11 ' A' ' 18' ' ' VAL . 0.2 OUTLIER -71.21 -38.58 72.03 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.733 179.367 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.624 ' HD3' ' O ' ' A' ' 10' ' ' ILE . 0.3 OUTLIER -74.38 -31.89 62.54 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.691 176.775 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -63.43 -32.09 73.43 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.354 175.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -98.15 10.28 40.9 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.485 -177.444 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 55.4 mm-40 58.11 31.92 21.34 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.911 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.537 HG11 HD13 ' A' ' 13' ' ' LEU . 65.1 t -69.92 123.31 23.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.617 -176.19 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -142.07 -159.45 0.97 Allowed 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 170.205 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.5 t -59.02 -17.32 24.09 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -176.423 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.2 t -77.67 -3.78 42.79 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 122.133 -0.354 . . . . 0.0 111.414 178.078 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.522 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 7.8 m95 -99.43 138.1 37.0 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.234 176.855 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 87.7 p -110.5 178.91 4.23 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 170.586 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.536 ' CD1' HD12 ' A' ' 27' ' ' ILE . 15.9 t80 -86.14 16.69 4.1 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.999 0.904 . . . . 0.0 109.272 178.713 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.7 t -93.48 -38.18 11.55 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 169.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.522 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 29.3 ttt180 -71.56 -33.32 69.01 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 114.049 -1.432 . . . . 0.0 109.166 177.785 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.571 HG12 HD22 ' A' ' 31' ' ' LEU . 29.3 mt -64.92 -50.24 75.97 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.391 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.121 173.669 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 24' ' ' PHE . 44.6 mm -62.59 -43.19 98.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 119.822 -0.751 . . . . 0.0 111.198 177.631 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 48.4 t -70.58 -38.59 74.08 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -176.162 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.507 ' HB3' ' HE ' ' A' ' 34' ' ' ARG . 20.4 mm-40 -113.83 -34.95 5.29 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -171.196 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.571 HD22 HG12 ' A' ' 27' ' ' ILE . 0.5 OUTLIER -87.65 -26.36 23.06 Favored 'General case' 0 C--N 1.319 -0.754 0 O-C-N 121.771 -0.581 . . . . 0.0 111.01 -175.106 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -86.1 9.19 70.5 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.707 -0.759 . . . . 0.0 111.518 175.326 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 46.0 p -132.02 -54.0 0.98 Allowed 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -177.616 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.507 ' HE ' ' HB3' ' A' ' 30' ' ' GLU . 65.9 mtt-85 -52.87 -46.06 67.74 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -177.811 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.503 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 9.3 t70 -139.21 132.84 15.86 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.999 -171.071 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.503 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 17.3 Cg_exo -68.29 -2.21 8.6 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 123.32 2.68 . . . . 0.0 113.35 -178.732 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.474 ' HE ' ' CG ' ' A' ' 35' ' ' ASP . 48.0 mtm180 -56.13 -30.32 61.96 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 176.321 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.403 ' CE1' ' HD2' ' A' ' 48' ' ' LYS . 67.7 t80 -69.5 -21.76 63.65 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.767 0.318 . . . . 0.0 110.393 178.359 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 62.6 m95 -104.08 -19.98 13.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.93 -174.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.455 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 38.2 mtm -60.8 -39.64 89.66 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.474 0.654 . . . . 0.0 109.559 177.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.603 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 5.2 p -88.38 130.65 37.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.102 -0.953 . . . . 0.0 108.664 169.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.23 136.74 58.05 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-O 121.447 0.642 . . . . 0.0 109.637 178.061 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.407 ' O ' ' HD3' ' A' ' 45' ' ' PRO . 29.5 t70 -75.88 96.47 3.72 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 114.882 -1.053 . . . . 0.0 112.091 -166.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -100.84 95.91 5.02 Favored Pre-proline 0 C--N 1.321 -0.643 0 N-CA-C 107.113 -1.439 . . . . 0.0 107.113 165.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.661 ' HA ' ' HB2' ' A' ' 48' ' ' LYS . 19.4 Cg_exo -67.11 -23.56 45.8 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 122.421 2.08 . . . . 0.0 112.107 -171.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -71.24 -38.32 71.95 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 56.4 t90 -75.72 -38.27 58.7 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 172.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.661 ' HB2' ' HA ' ' A' ' 45' ' ' PRO . 27.0 mmtp -61.01 -35.81 77.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.328 179.171 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.531 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 43.8 mttt -80.38 -40.29 26.81 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.669 179.58 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -66.14 -37.95 86.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.321 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 1.3 ppp? -71.73 -32.85 68.18 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.497 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 35.6 t80 -71.01 -37.96 72.65 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.665 176.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.531 ' HG2' ' O ' ' A' ' 49' ' ' LYS . 24.2 mm-40 -66.51 -30.84 71.25 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 175.522 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -72.45 -37.96 68.4 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.2 178.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.685 ' HA ' ' HA ' ' A' ' 59' ' ' ARG . 75.7 t80 -70.98 -24.51 62.41 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.75 -177.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 82.8 mt -87.95 -34.02 18.24 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.791 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.6 p -86.35 -41.11 14.79 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.952 0.406 . . . . 0.0 111.407 -178.5 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -118.13 -42.17 2.82 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.163 -176.757 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.685 ' HA ' ' HA ' ' A' ' 55' ' ' TYR . 39.0 ttm180 . . . . . 0 C--O 1.247 0.943 0 CA-C-O 118.123 -0.942 . . . . 0.0 110.378 -177.431 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.489 ' O ' ' HG2' ' A' ' 7' ' ' LYS . 34.4 mmt . . . . . 0 CA--C 1.518 -0.264 0 CA-C-O 120.631 0.253 . . . . 0.0 110.336 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -68.15 -35.0 77.36 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 176.006 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.501 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -64.25 -41.21 97.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.388 175.33 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.512 ' O ' HG12 ' A' ' 10' ' ' ILE . 29.8 tt0 -57.39 -47.03 82.74 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.038 176.572 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.565 ' HE2' ' N ' ' A' ' 7' ' ' LYS . 9.4 mmpt? -52.5 -52.35 54.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.446 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -62.78 -39.02 92.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.551 178.167 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.525 ' CE2' ' HG3' ' A' ' 48' ' ' LYS . 16.2 t80 -63.11 -39.48 94.81 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.465 -178.839 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.595 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 47.4 mm -74.31 -37.11 44.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.183 0.516 . . . . 0.0 110.226 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 29.9 m -64.11 -34.82 78.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.597 0.713 . . . . 0.0 110.289 176.386 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 33.4 ttp -75.93 -30.68 58.8 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.281 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.452 HD13 HG11 ' A' ' 18' ' ' VAL . 0.1 OUTLIER -70.36 -38.41 74.77 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.042 179.128 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.595 ' HD3' ' O ' ' A' ' 10' ' ' ILE . 0.0 OUTLIER -72.18 -33.48 67.7 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.756 0.313 . . . . 0.0 110.485 176.258 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -66.19 -26.76 67.55 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 121.288 0.566 . . . . 0.0 111.511 176.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 -102.02 14.57 31.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.785 -177.275 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 53.95 31.42 13.39 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.849 175.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.452 HG11 HD13 ' A' ' 13' ' ' LEU . 66.4 t -67.12 136.06 27.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.245 0.545 . . . . 0.0 111.634 -173.082 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -157.94 -160.21 0.89 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.349 175.5 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 p -55.51 -24.39 31.47 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 123.383 0.427 . . . . 0.0 112.098 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.6 p -69.96 -11.17 60.67 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 120.972 0.415 . . . . 0.0 112.0 -179.189 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.579 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 11.5 m95 -95.75 133.83 39.39 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.169 0.509 . . . . 0.0 110.969 179.099 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 m -105.86 168.54 9.05 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 168.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.583 ' CD1' HD12 ' A' ' 27' ' ' ILE . 18.9 t80 -82.5 15.78 2.39 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 122.087 0.946 . . . . 0.0 109.912 -176.261 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.6 t -92.84 -34.3 13.89 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.173 -1.376 . . . . 0.0 107.674 170.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.579 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 40.8 ttt180 -70.14 -36.14 74.56 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.618 -1.174 . . . . 0.0 108.99 178.045 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.61 HG23 HD23 ' A' ' 31' ' ' LEU . 52.4 mt -64.77 -47.14 89.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.334 176.727 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.6 mt -70.51 -42.79 78.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 C-N-CA 119.546 -0.861 . . . . 0.0 111.705 177.62 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.3 t -77.55 -39.02 47.35 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -171.042 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 22.9 mm-40 -111.52 -35.39 5.81 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 121.077 0.465 . . . . 0.0 111.345 -174.362 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.61 HD23 HG23 ' A' ' 27' ' ' ILE . 11.4 tp -84.87 -36.67 21.39 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.478 -168.741 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -68.07 -17.42 69.83 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.763 174.261 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 65.1 p -107.1 -1.9 21.54 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 122.452 -0.44 . . . . 0.0 111.564 -178.736 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 60.3 mtt-85 -88.99 -47.37 8.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.542 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.495 ' OD1' ' HG3' ' A' ' 37' ' ' ARG . 11.8 t70 -149.32 137.41 11.71 Favored Pre-proline 0 C--N 1.325 -0.469 0 C-N-CA 120.904 -0.319 . . . . 0.0 111.222 -172.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.521 ' HA ' ' HD1' ' A' ' 39' ' ' TRP . 34.2 Cg_exo -63.32 -7.02 11.15 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.681 2.92 . . . . 0.0 113.959 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.495 ' HG3' ' OD1' ' A' ' 35' ' ' ASP . 47.0 mtm180 -56.41 -28.79 60.4 Favored 'General case' 0 CA--C 1.529 0.146 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 174.878 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -71.96 -20.27 61.76 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.816 0.341 . . . . 0.0 110.686 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.521 ' HD1' ' HA ' ' A' ' 36' ' ' PRO . 56.7 m95 -106.81 -23.53 12.36 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.436 -175.763 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 39.3 ttm -51.91 -47.3 64.68 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 121.36 0.6 . . . . 0.0 109.951 175.473 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.501 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 2.5 p -87.43 116.67 30.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 167.697 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -58.19 145.42 37.23 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 121.464 0.649 . . . . 0.0 110.98 -173.659 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -63.33 98.09 0.15 Allowed 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.25 -1.341 . . . . 0.0 113.909 -164.106 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -111.11 95.94 27.65 Favored Pre-proline 0 N--CA 1.426 -1.628 0 CA-C-N 113.121 -1.854 . . . . 0.0 108.97 166.807 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_exo -67.71 -32.87 29.28 Favored 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 122.663 2.242 . . . . 0.0 112.662 -173.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.681 ' HA ' ' HE3' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -70.63 -36.39 73.44 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.881 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 47' ' ' TRP . . . . . 0.496 ' O ' ' HG2' ' A' ' 51' ' ' MET . 39.6 t90 -74.2 -39.27 63.26 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 119.608 -0.837 . . . . 0.0 110.111 175.898 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.525 ' HG3' ' CE2' ' A' ' 9' ' ' PHE . 0.0 OUTLIER -63.83 -32.77 74.39 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 176.312 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.681 ' HE3' ' HA ' ' A' ' 46' ' ' LEU . 12.0 ptpt -78.72 -38.59 38.62 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.136 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -68.52 -42.03 79.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.642 179.534 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.496 ' HG2' ' O ' ' A' ' 47' ' ' TRP . 15.6 ptm -74.22 -26.65 60.38 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.54 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 39.8 t80 -70.33 -37.15 74.63 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-N 115.938 -0.573 . . . . 0.0 109.605 175.03 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -66.57 -30.85 71.25 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.941 175.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -72.85 -37.39 67.43 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-O 121.353 0.597 . . . . 0.0 109.904 177.444 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.437 ' HE2' ' O ' ' A' ' 18' ' ' VAL . 75.1 t80 -71.49 -24.71 62.03 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.643 -178.094 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 40.2 mt -93.7 -33.47 13.63 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.369 178.585 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 21.2 t -100.06 25.06 7.8 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.36 0.6 . . . . 0.0 110.664 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -171.11 -66.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.051 177.73 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.426 ' HB2' ' O ' ' A' ' 55' ' ' TYR . 36.6 ttm180 . . . . . 0 C--O 1.249 1.038 0 O-C-N 124.333 1.02 . . . . 0.0 109.543 -172.801 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 18.6 ttt . . . . . 0 N--CA 1.448 -0.559 0 CA-C-O 121.583 0.706 . . . . 0.0 110.007 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -62.7 -44.04 97.26 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.028 178.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.674 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -60.31 -45.03 94.81 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.24 177.737 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.452 ' O ' HG12 ' A' ' 10' ' ' ILE . 29.2 tt0 -57.34 -54.39 47.38 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 121.131 0.491 . . . . 0.0 110.254 177.115 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.1 ttpt -50.15 -50.35 49.19 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.009 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -61.09 -40.18 92.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.046 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.62 ' CZ ' ' HG3' ' A' ' 48' ' ' LYS . 25.4 t80 -67.38 -40.1 85.68 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.91 -177.096 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.453 HG22 ' HE3' ' A' ' 14' ' ' LYS . 40.1 mm -74.88 -36.34 38.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.28 0.562 . . . . 0.0 110.284 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.4 m -71.38 -28.11 63.8 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.406 177.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.482 ' SD ' ' HB3' ' A' ' 35' ' ' ASP . 27.2 ttp -74.47 -34.6 63.16 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 177.732 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.437 HD13 HG11 ' A' ' 18' ' ' VAL . 0.1 OUTLIER -68.59 -38.03 80.31 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.04 178.396 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.453 ' HE3' HG22 ' A' ' 10' ' ' ILE . 33.6 mttt -68.81 -43.15 76.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.205 0.526 . . . . 0.0 111.04 176.504 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -66.08 -29.64 70.01 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.025 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -91.68 11.19 25.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.657 0.265 . . . . 0.0 111.087 177.134 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 55.29 31.84 17.43 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.535 176.339 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.437 HG11 HD13 ' A' ' 13' ' ' LEU . 58.7 t -65.73 130.04 30.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.405 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -140.87 -164.15 1.68 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.429 176.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.2 p -56.21 -28.31 57.85 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -178.397 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 79.6 p -75.39 -6.77 51.7 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.027 0.441 . . . . 0.0 111.999 -176.792 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.747 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 9.8 m95 -89.38 126.08 35.4 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.112 0.482 . . . . 0.0 111.442 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.433 ' C ' ' H ' ' A' ' 25' ' ' SER . 30.4 t -83.89 155.65 22.79 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 167.54 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.576 ' CZ ' ' HB3' ' A' ' 48' ' ' LYS . 91.0 t80 -81.0 15.35 1.87 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-O 122.709 1.242 . . . . 0.0 109.356 -179.026 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.433 ' H ' ' C ' ' A' ' 23' ' ' SER . 15.1 t -92.28 -30.72 15.71 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 113.136 -1.847 . . . . 0.0 107.366 171.342 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.747 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 62.7 ttt180 -73.49 -37.63 65.66 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 114.478 -1.237 . . . . 0.0 109.59 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.55 ' O ' ' HB2' ' A' ' 31' ' ' LEU . 64.5 mt -63.12 -52.33 60.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.615 175.207 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 76.6 mt -61.11 -42.16 92.15 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 120.069 -0.652 . . . . 0.0 111.27 178.389 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.2 t -77.97 -39.13 43.51 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -172.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.578 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 12.8 mt-10 -107.33 -37.07 6.34 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.973 -0.691 . . . . 0.0 111.993 -176.339 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.55 ' HB2' ' O ' ' A' ' 27' ' ' ILE . 1.2 mp -78.13 -31.11 49.69 Favored 'General case' 0 C--N 1.323 -0.566 0 O-C-N 122.025 -0.422 . . . . 0.0 111.315 -172.034 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.11 -32.84 67.82 Favored Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.546 176.128 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.7 t -104.32 -19.39 14.1 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -178.039 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.578 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 62.2 mtt-85 -74.63 -34.39 62.77 Favored 'General case' 0 CA--C 1.517 -0.302 0 O-C-N 122.316 -0.24 . . . . 0.0 111.628 179.216 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.482 ' HB3' ' SD ' ' A' ' 12' ' ' MET . 8.7 t0 -147.76 129.78 7.53 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-O 120.994 0.426 . . . . 0.0 111.087 -175.397 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 16.9 Cg_exo -68.71 -6.0 16.81 Favored 'Trans proline' 0 CA--C 1.529 0.251 0 C-N-CA 123.363 2.708 . . . . 0.0 112.795 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.548 ' HA ' ' HG2' ' A' ' 40' ' ' MET . 51.9 mtt180 -61.69 -25.08 67.18 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.625 0.231 . . . . 0.0 111.625 176.386 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -68.13 -21.64 64.92 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 176.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 48.6 m95 -99.36 -17.13 18.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.485 -177.005 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.548 ' HG2' ' HA ' ' A' ' 37' ' ' ARG . 86.2 mmm -49.61 -38.62 32.52 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.317 0.579 . . . . 0.0 110.564 175.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.674 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 3.5 p -113.07 129.95 67.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.084 173.075 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.45 143.12 50.8 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-O 121.45 0.643 . . . . 0.0 109.714 177.617 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.464 ' O ' ' HD3' ' A' ' 45' ' ' PRO . 25.6 t0 -76.79 99.31 5.09 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.05 -0.977 . . . . 0.0 113.153 -160.635 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -96.22 99.26 5.01 Favored Pre-proline 0 C--N 1.324 -0.536 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 166.145 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.464 ' HD3' ' O ' ' A' ' 43' ' ' ASP . 37.6 Cg_exo -62.38 -30.32 80.48 Favored 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 122.934 2.423 . . . . 0.0 112.765 -174.75 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.461 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 1.1 tm? -71.18 -39.03 72.1 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.219 -0.659 . . . . 0.0 109.219 -179.177 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' TRP . . . . . 0.455 ' O ' ' HG2' ' A' ' 51' ' ' MET . 42.5 t90 -75.2 -38.53 60.7 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.454 176.725 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.62 ' HG3' ' CZ ' ' A' ' 9' ' ' PHE . 2.1 mptm? -62.83 -33.99 76.39 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.628 177.616 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.426 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 33.4 mttt -75.37 -38.75 59.83 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.477 176.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.461 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 32.3 mt-10 -62.37 -47.48 84.0 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.264 177.514 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.455 ' HG2' ' O ' ' A' ' 47' ' ' TRP . 13.5 ptm -73.13 -22.74 60.47 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.098 -176.667 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.505 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 24.0 t80 -76.97 -38.43 53.26 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.53 176.773 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 49' ' ' LYS . 47.2 mm-40 -67.31 -33.83 76.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.924 0.393 . . . . 0.0 110.019 176.682 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.2 tttt -72.32 -37.73 68.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.866 175.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -61.85 -31.75 72.04 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.52 178.391 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 83.1 mt -84.15 -33.28 24.29 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -178.657 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 72.4 p -106.26 9.16 32.13 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -175.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.48 ' O ' ' HB2' ' A' ' 59' ' ' ARG . 0.2 OUTLIER -153.09 -49.79 0.1 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.741 -0.209 . . . . 0.0 110.498 -176.759 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.48 ' HB2' ' O ' ' A' ' 58' ' ' ASN . 50.9 mtt180 . . . . . 0 C--O 1.247 0.931 0 O-C-N 124.113 0.883 . . . . 0.0 110.168 -178.296 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.427 ' O ' ' HG3' ' A' ' 7' ' ' LYS . 65.0 mtm . . . . . 0 CA--C 1.517 -0.289 0 CA-C-O 121.16 0.505 . . . . 0.0 109.997 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -58.49 -56.56 20.61 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.963 -175.049 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.604 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -64.67 -34.44 78.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.647 -176.174 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.769 ' HG3' ' HE3' ' A' ' 51' ' ' MET . 34.6 tt0 -62.99 -52.87 61.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.898 0.38 . . . . 0.0 110.025 178.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.427 ' HG3' ' O ' ' A' ' 3' ' ' MET . 45.8 mtpt -64.33 -35.91 82.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.689 -179.269 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -61.66 -37.78 85.33 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.938 0.399 . . . . 0.0 110.185 174.379 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.572 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 30.3 t80 -71.43 -39.28 71.15 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.32 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 6' ' ' GLU . 47.5 mm -71.39 -37.7 66.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.281 0.562 . . . . 0.0 110.399 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 38.9 m -72.77 -24.37 60.94 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.193 175.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.761 ' HB2' ' HD2' ' A' ' 37' ' ' ARG . 46.7 ttp -75.18 -33.14 61.41 Favored 'General case' 0 CA--C 1.509 -0.611 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 178.67 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 9' ' ' PHE . 80.1 mt -68.06 -38.3 82.3 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.108 176.354 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 62.7 mttt -69.55 -40.38 76.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.256 0.551 . . . . 0.0 111.039 176.506 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -73.97 -13.32 60.86 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.823 179.232 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.544 ' OD1' ' HD2' ' A' ' 34' ' ' ARG . 0.9 OUTLIER -106.66 10.82 30.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.841 0.353 . . . . 0.0 110.644 177.546 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 41.9 mm-40 56.37 31.83 19.43 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.014 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.481 HG11 HD22 ' A' ' 13' ' ' LEU . 58.3 t -75.71 140.95 16.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.786 -178.32 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -157.94 -158.81 0.76 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.026 -0.533 . . . . 0.0 109.597 172.227 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.7 p -51.23 -32.25 23.52 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.1 t -85.32 25.86 0.96 Allowed 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.42 0.628 . . . . 0.0 111.88 -174.154 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.675 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 3.6 m95 -115.89 140.73 48.95 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.955 0.407 . . . . 0.0 110.873 178.625 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 84.9 p -97.08 168.49 10.42 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 173.19 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.472 ' CD1' HD12 ' A' ' 27' ' ' ILE . 41.7 t80 -89.04 15.75 8.19 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 122.172 0.987 . . . . 0.0 108.957 177.081 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.0 m -94.14 -42.9 8.74 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 113.842 -1.526 . . . . 0.0 107.462 170.543 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.675 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 19.7 ttt180 -60.58 -38.05 83.32 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 113.57 -1.65 . . . . 0.0 109.437 174.431 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.776 HG23 HD22 ' A' ' 31' ' ' LEU . 50.7 mt -61.15 -58.25 8.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.64 175.223 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 71.3 mt -60.18 -34.78 58.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.543 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.4 t -79.24 -38.85 34.61 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -174.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 26.8 mm-40 -104.05 -34.55 8.39 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 -173.479 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.776 HD22 HG23 ' A' ' 27' ' ' ILE . 5.1 mp -86.47 -15.06 41.33 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.434 0.635 . . . . 0.0 109.725 -176.015 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -83.34 -5.53 88.67 Favored Glycine 0 N--CA 1.439 -1.108 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.275 174.706 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 23.7 p -128.02 -45.44 1.41 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -175.129 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.544 ' HD2' ' OD1' ' A' ' 16' ' ' ASN . 47.1 mtt180 -53.5 -44.86 69.4 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -177.4 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.441 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 16.6 t70 -160.34 129.44 3.15 Favored Pre-proline 0 C--N 1.323 -0.559 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 177.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.505 ' O ' ' HG3' ' A' ' 40' ' ' MET . 16.3 Cg_exo -69.46 27.56 0.17 Allowed 'Trans proline' 0 CA--C 1.533 0.438 0 C-N-CA 123.577 2.852 . . . . 0.0 114.851 -171.241 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.761 ' HD2' ' HB2' ' A' ' 12' ' ' MET . 87.1 mtt180 -65.5 -28.42 69.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.122 0.487 . . . . 0.0 110.142 176.564 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.429 ' CE1' ' HD2' ' A' ' 48' ' ' LYS . 49.9 t80 -69.26 -20.57 63.93 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.461 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 46.4 m95 -103.63 -28.64 11.59 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.524 -175.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.581 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 47.9 mtm -55.56 -41.5 73.37 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.178 0.514 . . . . 0.0 110.207 178.674 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.604 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 3.4 p -89.91 123.08 41.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 169.5 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -58.86 143.8 46.41 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-O 121.68 0.752 . . . . 0.0 110.671 -176.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -75.37 98.29 3.82 Favored 'General case' 0 N--CA 1.436 -1.129 0 CA-C-N 114.667 -1.151 . . . . 0.0 113.594 -163.655 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -106.0 95.97 11.99 Favored Pre-proline 0 C--N 1.317 -0.818 0 N-CA-C 106.868 -1.531 . . . . 0.0 106.868 158.041 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.852 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 25.9 Cg_exo -62.68 -37.37 57.45 Favored 'Trans proline' 0 N--CA 1.449 -1.147 0 C-N-CA 121.997 1.798 . . . . 0.0 111.997 -173.399 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.484 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -61.4 -38.75 88.22 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.228 -179.822 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 48.4 t90 -69.25 -38.34 78.41 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-O 120.875 0.369 . . . . 0.0 110.038 173.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.429 ' HD2' ' CE1' ' A' ' 38' ' ' TYR . 23.4 mmtp -60.6 -33.36 72.62 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.363 177.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.852 ' HG3' ' O ' ' A' ' 45' ' ' PRO . 31.7 mtpt -82.54 -38.44 23.74 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.236 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 42.9 mt-10 -61.84 -39.02 90.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.285 0.564 . . . . 0.0 111.271 176.749 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.769 ' HE3' ' HG3' ' A' ' 6' ' ' GLU . 17.6 ptm -78.79 -26.96 44.45 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-O 121.217 0.532 . . . . 0.0 109.767 -178.421 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.517 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 33.7 t80 -71.36 -39.28 71.39 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.155 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -74.39 -22.16 59.31 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.546 0.689 . . . . 0.0 109.464 177.257 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.7 tptm -71.09 -37.51 72.42 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.49 172.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -68.16 -25.84 65.46 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.628 178.22 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 58.7 mt -86.43 -32.53 20.82 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.309 178.602 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -89.91 -49.21 6.74 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.131 0.491 . . . . 0.0 110.961 -177.891 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -86.36 -56.29 3.51 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.74 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 . . . . . 0 C--O 1.247 0.935 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.575 -179.522 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 29.6 ttp . . . . . 0 N--CA 1.45 -0.448 0 CA-C-O 121.12 0.486 . . . . 0.0 110.081 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -66.37 -44.51 82.93 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.846 178.441 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.429 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -60.03 -42.15 93.76 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.582 176.881 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -57.97 -46.71 84.7 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.798 177.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.484 ' HE2' ' HA ' ' A' ' 7' ' ' LYS . 5.8 mmpt? -48.72 -57.7 5.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.341 179.298 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.486 ' HB3' ' HD2' ' A' ' 37' ' ' ARG . 28.2 mt-10 -73.4 -29.85 62.87 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.53 -178.337 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.583 ' HE2' ' HE2' ' A' ' 48' ' ' LYS . 0.4 OUTLIER -58.98 -40.62 85.36 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 177.81 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.537 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 33.4 mm -71.56 -37.08 62.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.339 0.59 . . . . 0.0 110.354 177.7 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 23.1 m -64.2 -40.8 96.82 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.301 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.471 ' HG2' ' O ' ' A' ' 8' ' ' GLU . 16.4 ptm -75.68 -23.63 56.23 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -177.533 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 9' ' ' PHE . 85.2 mt -68.77 -39.89 79.98 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.628 174.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.537 ' HD3' ' O ' ' A' ' 10' ' ' ILE . 0.1 OUTLIER -71.56 -39.78 70.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.394 0.616 . . . . 0.0 110.422 177.126 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -75.45 -14.17 60.42 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.597 -0.729 . . . . 0.0 112.546 -175.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.431 ' HA ' HD22 ' A' ' 16' ' ' ASN . 0.8 OUTLIER -107.87 20.18 19.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.834 0.35 . . . . 0.0 110.928 176.274 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 59.79 31.64 20.91 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.339 175.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.493 HG22 ' CE2' ' A' ' 22' ' ' TRP . 51.6 t -78.15 128.85 38.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.029 0.442 . . . . 0.0 111.264 -177.361 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -150.34 -157.46 0.82 Allowed 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 171.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.8 m -65.46 -9.02 22.07 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.5 p -79.06 -16.92 56.11 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 121.019 0.438 . . . . 0.0 111.199 176.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.597 ' CE2' ' HD3' ' A' ' 26' ' ' ARG . 7.2 m95 -86.86 119.69 27.35 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.281 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.401 ' C ' ' H ' ' A' ' 25' ' ' SER . 5.5 m -83.93 165.49 18.64 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 168.574 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.563 ' CD1' HD12 ' A' ' 27' ' ' ILE . 29.3 t80 -82.46 16.48 2.08 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 122.454 1.121 . . . . 0.0 109.577 -175.004 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.401 ' H ' ' C ' ' A' ' 23' ' ' SER . 48.1 t -91.4 -31.59 15.97 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-N 113.673 -1.603 . . . . 0.0 107.452 172.165 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.597 ' HD3' ' CE2' ' A' ' 22' ' ' TRP . 28.7 ttt180 -75.05 -33.32 61.71 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.846 179.0 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.563 HD12 ' CD1' ' A' ' 24' ' ' PHE . 54.2 mt -66.15 -42.3 90.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.175 176.736 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.6 mt -74.58 -43.36 48.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 119.561 -0.855 . . . . 0.0 111.808 175.363 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.2 t -82.4 -38.87 23.47 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -169.429 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.815 ' O ' ' HB2' ' A' ' 34' ' ' ARG . 28.9 mm-40 -103.89 -35.77 8.03 Favored 'General case' 0 C--O 1.212 -0.902 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.319 -176.701 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.554 HD23 HG23 ' A' ' 27' ' ' ILE . 8.9 tp -87.57 -36.27 17.64 Favored 'General case' 0 C--N 1.315 -0.91 0 O-C-N 123.569 0.543 . . . . 0.0 111.153 -167.049 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.48 -49.35 79.55 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.297 177.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 68.8 p -83.41 -10.08 58.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.048 0.451 . . . . 0.0 111.64 -177.11 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.815 ' HB2' ' O ' ' A' ' 30' ' ' GLU . 53.2 ttm-85 -83.31 -45.16 14.1 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.051 -177.748 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.444 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 8.0 t70 -138.09 128.23 15.24 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.583 -176.36 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 20.6 Cg_exo -66.87 -13.06 38.48 Favored 'Trans proline' 0 N--CA 1.465 -0.168 0 C-N-CA 123.517 2.811 . . . . 0.0 113.269 -178.058 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.523 ' HA ' ' HB2' ' A' ' 40' ' ' MET . 79.7 mtm180 -64.54 -19.45 65.63 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -70.3 -24.44 63.02 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 121.082 0.467 . . . . 0.0 109.881 175.196 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 53.9 m95 -101.6 -18.86 15.71 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.768 -178.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.523 ' HB2' ' HA ' ' A' ' 37' ' ' ARG . 18.3 ttp -52.55 -46.51 66.82 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 121.407 0.622 . . . . 0.0 109.778 175.117 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.429 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 7.6 p -89.19 133.97 29.83 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 168.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.4 143.01 50.95 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-O 121.334 0.588 . . . . 0.0 109.829 177.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -82.53 97.52 8.48 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.892 -165.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -103.26 101.41 22.29 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 114.691 -1.14 . . . . 0.0 108.45 170.602 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -59.23 -25.56 78.62 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.872 2.382 . . . . 0.0 112.574 -176.393 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.411 ' HA ' HD22 ' A' ' 46' ' ' LEU . 0.7 OUTLIER -75.47 -39.3 58.87 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 -179.795 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 47.1 t90 -75.52 -38.38 59.44 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.567 176.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.583 ' HE2' ' HE2' ' A' ' 9' ' ' PHE . 2.8 mptm? -62.66 -33.23 74.62 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 176.309 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.406 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 24.9 mttm -75.73 -41.43 53.39 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 120.975 -0.29 . . . . 0.0 110.833 176.242 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -61.55 -48.15 82.32 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.226 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 3.5 ppp? -75.28 -27.69 59.49 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.787 -174.31 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.617 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 35.3 t80 -74.59 -38.97 62.47 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.678 178.867 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 49' ' ' LYS . 45.2 mt-10 -73.0 -23.05 60.59 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 176.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.442 ' HE3' ' ND2' ' A' ' 58' ' ' ASN . 31.8 tptt -73.22 -38.45 66.06 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.522 0.677 . . . . 0.0 109.456 172.307 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.713 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 61.7 t80 -71.75 -23.06 61.54 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.666 -177.652 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.617 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 56.3 mt -89.5 -33.8 16.64 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.961 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -95.72 -53.32 3.75 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.887 0.375 . . . . 0.0 110.805 -176.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.442 ' ND2' ' HE3' ' A' ' 54' ' ' LYS . 61.8 t30 -75.11 -53.38 8.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.018 178.765 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.713 ' HG2' ' O ' ' A' ' 55' ' ' TYR . 77.1 mtt180 . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.438 -178.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 83.1 mtp . . . . . 0 C--O 1.236 0.389 0 CA-C-O 121.025 0.44 . . . . 0.0 109.952 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.582 ' O ' ' HG3' ' A' ' 8' ' ' GLU . 23.1 mt-10 -64.1 -40.59 96.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.941 176.724 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.679 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -63.22 -35.69 81.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.685 -178.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.54 ' O ' HG12 ' A' ' 10' ' ' ILE . 32.6 tt0 -58.8 -51.26 70.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.352 0.596 . . . . 0.0 109.849 174.271 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.432 ' HE2' ' HB3' ' A' ' 7' ' ' LYS . 51.1 mtpt -63.03 -39.33 94.44 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.012 -179.099 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.582 ' HG3' ' O ' ' A' ' 4' ' ' GLU . 42.5 mt-10 -63.36 -40.23 96.69 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 120.904 0.383 . . . . 0.0 110.066 176.076 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.45 ' HA ' ' HG2' ' A' ' 12' ' ' MET . 48.2 t80 -60.75 -37.83 83.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.104 176.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.628 ' O ' ' HD2' ' A' ' 14' ' ' LYS . 41.0 mm -71.81 -37.08 60.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.387 178.194 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.6 m -66.67 -40.55 88.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.486 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.528 ' SD ' ' HB3' ' A' ' 37' ' ' ARG . 24.3 ptm -73.41 -22.24 60.28 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.512 HD23 ' HG3' ' A' ' 12' ' ' MET . 0.1 OUTLIER -70.45 -37.83 74.39 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.335 176.563 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.628 ' HD2' ' O ' ' A' ' 10' ' ' ILE . 3.8 mptt -68.16 -37.71 81.3 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.321 0.582 . . . . 0.0 109.847 173.65 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -66.21 -36.78 83.94 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.95 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -88.95 10.12 22.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.056 -179.159 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 61.71 31.79 18.48 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.37 176.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.479 HG11 HD13 ' A' ' 13' ' ' LEU . 40.2 t -75.75 139.47 18.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.682 0.277 . . . . 0.0 110.871 -177.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.469 ' OD1' HG22 ' A' ' 21' ' ' THR . 4.5 p-10 -156.4 -161.02 1.05 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.023 175.68 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.686 ' HA ' HD22 ' A' ' 56' ' ' LEU . 69.3 m -60.39 -30.52 69.64 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -175.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.469 HG22 ' OD1' ' A' ' 19' ' ' ASP . 13.2 t -81.19 11.31 4.34 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.991 0.424 . . . . 0.0 111.935 -175.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.449 ' CH2' HD11 ' A' ' 31' ' ' LEU . 5.3 m95 -96.67 138.87 33.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.201 0.525 . . . . 0.0 111.56 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -97.03 154.85 17.07 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 171.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.467 ' HD1' HD12 ' A' ' 27' ' ' ILE . 67.2 t80 -86.19 14.96 5.62 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 122.196 0.998 . . . . 0.0 110.358 -175.303 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.0 m -93.31 -33.31 13.96 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 114.315 -1.311 . . . . 0.0 107.581 168.317 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -70.13 -36.91 75.12 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 114.05 -1.432 . . . . 0.0 109.512 176.646 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.725 HG23 HD22 ' A' ' 31' ' ' LEU . 28.4 mt -61.1 -54.95 28.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.244 173.5 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 68.4 mt -61.55 -37.1 77.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 120.022 -0.671 . . . . 0.0 111.459 179.249 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.8 t -79.29 -40.94 29.21 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -173.882 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -99.86 -34.14 10.26 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.851 -175.361 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.725 HD22 HG23 ' A' ' 27' ' ' ILE . 4.2 mp -84.47 -23.51 29.86 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 -176.07 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -76.45 -13.34 83.51 Favored Glycine 0 N--CA 1.444 -0.814 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.588 174.39 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.4 p -114.58 -45.94 2.98 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 -176.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 90.1 mtt-85 -56.38 -44.69 80.46 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -177.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.444 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 9.7 t70 -145.91 130.64 8.93 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-O 120.829 0.347 . . . . 0.0 111.067 -173.786 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 24.5 Cg_exo -64.66 -4.99 9.39 Favored 'Trans proline' 0 CA--C 1.531 0.375 0 C-N-CA 123.6 2.866 . . . . 0.0 113.744 -178.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.528 ' HB3' ' SD ' ' A' ' 12' ' ' MET . 13.3 mtm180 -55.28 -28.64 54.82 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 176.074 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 70.9 t80 -68.64 -20.21 64.46 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.001 0.429 . . . . 0.0 110.133 178.47 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 58.7 m95 -107.05 -21.95 12.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.241 -177.275 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 85.0 mtp -58.17 -42.48 86.13 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.442 0.639 . . . . 0.0 109.341 174.289 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.679 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 6.7 p -86.21 132.01 33.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.328 -0.851 . . . . 0.0 108.842 169.403 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.19 143.58 48.54 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-O 121.482 0.658 . . . . 0.0 110.282 179.176 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -94.03 97.71 10.51 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.385 -166.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -105.88 97.83 16.39 Favored Pre-proline 0 N--CA 1.442 -0.862 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 163.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.62 ' HA ' ' HB2' ' A' ' 48' ' ' LYS . 24.2 Cg_exo -63.1 -22.37 73.18 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.65 2.234 . . . . 0.0 112.474 -171.653 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -74.78 -39.27 61.84 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 177.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' TRP . . . . . 0.404 ' O ' ' HG2' ' A' ' 51' ' ' MET . 45.3 t90 -72.93 -38.36 66.86 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 173.378 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.62 ' HB2' ' HA ' ' A' ' 45' ' ' PRO . 24.8 mmtp -59.78 -33.66 71.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.185 177.548 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.599 ' HB3' ' O ' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -87.07 -32.82 19.75 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.509 -178.657 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -67.14 -39.55 86.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.048 0.451 . . . . 0.0 111.131 176.313 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.499 ' HE3' ' HG3' ' A' ' 6' ' ' GLU . 16.9 ptm -74.79 -26.39 59.71 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.719 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.665 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 32.4 t80 -69.37 -36.06 76.45 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.209 173.007 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.511 ' HG2' ' O ' ' A' ' 49' ' ' LYS . 38.0 mm-40 -65.13 -31.95 73.4 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.248 0.547 . . . . 0.0 109.651 175.807 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -72.99 -38.6 66.59 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.99 177.03 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.426 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 86.1 t80 -70.02 -20.99 63.24 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.084 -177.556 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.686 HD22 ' HA ' ' A' ' 20' ' ' SER . 87.1 mt -81.75 -33.24 31.12 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.258 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 37.0 p -100.32 -46.45 5.26 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.9 0.381 . . . . 0.0 111.632 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.416 ' O ' ' HB2' ' A' ' 59' ' ' ARG . 6.8 t30 -89.59 -47.65 7.82 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.705 -176.347 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.426 ' HG2' ' O ' ' A' ' 55' ' ' TYR . 76.3 mtt180 . . . . . 0 C--O 1.251 1.151 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.231 -173.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 78.5 mtp . . . . . 0 N--CA 1.456 -0.172 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -63.03 -30.82 71.9 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.305 0.574 . . . . 0.0 110.041 177.242 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.605 ' O ' ' HB2' ' A' ' 9' ' ' PHE . . . -56.18 -56.45 20.72 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.691 177.368 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.44 ' O ' HG12 ' A' ' 10' ' ' ILE . 28.9 tt0 -71.06 -47.12 60.22 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.972 -178.251 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.631 ' HE2' ' O ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -42.3 -64.1 0.65 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.772 -1.104 . . . . 0.0 111.305 176.45 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.539 ' HB3' ' HD2' ' A' ' 37' ' ' ARG . 56.0 mm-40 -78.41 -16.71 57.32 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.75 -0.38 . . . . 0.0 112.009 -175.054 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.605 ' HB2' ' O ' ' A' ' 5' ' ' ALA . 21.3 t80 -69.5 -40.04 77.25 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 175.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 6' ' ' GLU . 46.0 mm -74.41 -36.31 41.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 121.551 0.691 . . . . 0.0 109.824 178.011 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 19.9 m -66.92 -33.29 75.27 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.607 178.275 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 18.1 ttp -76.57 -32.4 58.12 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.107 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.473 HD13 HG11 ' A' ' 18' ' ' VAL . 0.1 OUTLIER -68.43 -38.57 81.3 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.104 179.105 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 14.3 mtpt -68.18 -40.96 82.1 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.012 0.434 . . . . 0.0 110.845 175.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.437 ' CD ' HH22 ' A' ' 37' ' ' ARG . 29.8 mt-10 -67.05 -18.56 65.4 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.078 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -105.05 16.56 25.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.785 178.186 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 56.28 32.42 20.36 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.527 -0.761 . . . . 0.0 112.682 176.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.473 HG11 HD13 ' A' ' 13' ' ' LEU . 58.1 t -76.41 119.41 24.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.008 0.433 . . . . 0.0 111.288 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -128.58 -156.0 0.73 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.507 172.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.1 p -68.91 -8.72 46.81 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.034 0.445 . . . . 0.0 111.365 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.4 p -79.77 9.66 4.94 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.781 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.682 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 11.7 m95 -117.76 146.2 43.96 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.15 0.5 . . . . 0.0 111.876 -175.756 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.9 m -110.17 164.93 12.16 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 165.63 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.682 ' CE1' ' HB3' ' A' ' 48' ' ' LYS . 88.5 t80 -82.99 16.27 2.39 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 122.308 1.051 . . . . 0.0 110.891 -171.546 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.5 m -92.16 -32.55 15.06 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 113.861 -1.518 . . . . 0.0 107.947 171.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.682 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 42.5 ttt180 -71.07 -35.46 71.9 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.408 -1.269 . . . . 0.0 109.398 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.555 HG12 HD22 ' A' ' 31' ' ' LEU . 54.9 mt -64.62 -54.45 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.867 175.131 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.1 mt -62.23 -40.19 86.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 C-N-CA 119.691 -0.804 . . . . 0.0 111.348 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.6 t -76.96 -39.27 51.22 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -173.291 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -112.65 -33.28 6.18 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -173.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.555 HD22 HG12 ' A' ' 27' ' ' ILE . 1.6 mp -78.28 -30.27 48.41 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 122.04 -0.413 . . . . 0.0 110.859 -177.089 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.66 -18.61 64.04 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.731 -0.747 . . . . 0.0 111.969 175.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.0 p -112.06 -27.69 8.29 Favored 'General case' 0 C--O 1.234 0.254 0 O-C-N 122.381 -0.481 . . . . 0.0 111.996 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.9 mtm180 -74.67 -30.48 61.6 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -178.502 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.467 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 7.9 t70 -151.48 128.97 5.67 Favored Pre-proline 0 C--N 1.329 -0.3 0 C-N-CA 120.199 -0.6 . . . . 0.0 111.185 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 16.3 Cg_exo -69.85 -5.34 16.02 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 123.466 2.777 . . . . 0.0 113.825 -178.208 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.539 ' HD2' ' HB3' ' A' ' 8' ' ' GLU . 57.7 mtm180 -60.62 -22.28 63.61 Favored 'General case' 0 C--N 1.333 -0.123 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 176.25 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 69.1 t80 -68.3 -20.62 64.77 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.899 0.381 . . . . 0.0 110.007 176.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 56.7 m95 -105.25 -17.88 14.31 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.4 -176.358 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 90.5 mmm -57.65 -37.77 73.94 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.324 0.583 . . . . 0.0 109.87 175.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 6.3 p -96.62 141.3 15.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.455 -0.793 . . . . 0.0 108.886 169.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -59.92 143.7 50.85 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-O 121.616 0.722 . . . . 0.0 109.735 175.166 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -81.56 97.25 7.75 Favored 'General case' 0 C--N 1.301 -1.509 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.089 -171.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -102.05 98.25 9.81 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 170.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -61.41 -30.57 87.31 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.66 2.24 . . . . 0.0 112.699 -173.65 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.475 ' HA ' HD22 ' A' ' 46' ' ' LEU . 0.6 OUTLIER -72.53 -40.0 67.1 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.742 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 47' ' ' TRP . . . . . 0.484 ' O ' ' HG2' ' A' ' 51' ' ' MET . 41.8 t90 -73.79 -38.04 64.76 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-N 116.778 -0.192 . . . . 0.0 110.567 176.792 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.682 ' HB3' ' CE1' ' A' ' 24' ' ' PHE . 2.5 mptm? -63.37 -33.37 75.38 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.289 177.283 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.415 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 23.7 mttm -73.76 -40.6 63.37 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 120.927 0.394 . . . . 0.0 110.19 176.018 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 42.8 mt-10 -63.23 -44.64 94.68 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.067 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.484 ' HG2' ' O ' ' A' ' 47' ' ' TRP . 13.5 ptm -76.7 -21.61 55.08 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.215 -176.634 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.409 ' CZ ' HD11 ' A' ' 56' ' ' LEU . 22.5 t80 -76.35 -37.95 56.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.167 176.294 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 49' ' ' LYS . 37.7 mt-10 -67.56 -30.95 70.72 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 175.402 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.4 tttt -71.85 -37.69 70.2 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.392 175.358 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -66.85 -23.72 66.06 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.941 0.4 . . . . 0.0 111.039 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.409 HD11 ' CZ ' ' A' ' 52' ' ' PHE . 67.4 mt -98.6 -33.46 10.96 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.6 t -89.48 -23.32 22.12 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.05 0.453 . . . . 0.0 111.233 -177.16 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -126.41 -53.06 1.48 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.665 -178.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 . . . . . 0 C--O 1.251 1.164 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.585 -179.688 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 12.6 tpt . . . . . 0 N--CA 1.448 -0.549 0 CA-C-O 121.112 0.482 . . . . 0.0 109.978 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -65.11 -47.7 76.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.726 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.572 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -59.28 -43.36 92.55 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.58 -1.191 . . . . 0.0 111.265 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.721 ' HG3' ' HE3' ' A' ' 51' ' ' MET . 32.1 tt0 -63.78 -49.55 72.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.014 0.435 . . . . 0.0 110.641 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.46 ' HE2' ' HB3' ' A' ' 7' ' ' LYS . 15.1 ttpt -49.73 -51.45 38.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.362 -0.836 . . . . 0.0 112.122 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -71.32 -33.55 69.75 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.044 -179.433 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.637 ' O ' HD23 ' A' ' 13' ' ' LEU . 36.2 t80 -61.68 -38.17 86.83 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.133 0.492 . . . . 0.0 110.113 177.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.515 HG12 ' O ' ' A' ' 6' ' ' GLU . 44.4 mm -71.97 -35.91 55.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.349 0.595 . . . . 0.0 110.145 177.653 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 48.4 m -67.94 -41.5 82.45 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.642 -179.059 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.555 ' SD ' ' HA ' ' A' ' 9' ' ' PHE . 21.7 ptm -70.44 -28.99 65.46 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -179.574 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.637 HD23 ' O ' ' A' ' 9' ' ' PHE . 1.8 mm? -68.46 -37.4 80.15 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.022 177.92 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.412 ' HE3' ' HE1' ' A' ' 55' ' ' TYR . 12.6 mttt -69.73 -38.51 76.91 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.925 175.367 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -68.28 -27.5 66.38 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.768 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.583 ' ND2' ' HG ' ' A' ' 31' ' ' LEU . 94.3 m-20 -90.82 9.5 29.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.216 -179.151 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 57.48 31.35 20.11 Favored 'General case' 0 CA--C 1.526 0.046 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.267 176.733 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.605 HG21 HD13 ' A' ' 13' ' ' LEU . 66.3 t -74.1 129.45 36.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.605 -175.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -120.57 -162.58 0.95 Allowed 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 170.81 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.6 p -77.24 -6.45 53.11 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.899 0.38 . . . . 0.0 111.693 -178.083 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.5 p -81.8 -13.48 57.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.904 0.383 . . . . 0.0 111.459 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.517 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 6.1 m95 -74.2 136.02 42.78 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.704 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.8 t -90.25 156.66 18.14 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 169.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.538 ' CZ ' ' HB3' ' A' ' 48' ' ' LYS . 42.1 t80 -83.49 16.68 2.48 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 122.123 0.963 . . . . 0.0 109.513 -177.183 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 27.4 t -93.1 -41.7 9.8 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.135 -1.393 . . . . 0.0 107.611 171.288 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.517 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 54.2 ttt180 -65.25 -34.29 78.02 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.092 -1.413 . . . . 0.0 109.506 176.599 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.749 HG23 HD22 ' A' ' 31' ' ' LEU . 59.6 mt -62.99 -56.76 15.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.153 174.575 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.473 HG12 ' O ' ' A' ' 24' ' ' PHE . 40.1 mm -59.59 -38.46 75.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 120.583 -0.447 . . . . 0.0 111.644 179.125 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.8 t -82.16 -38.81 24.13 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -171.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.531 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 8.3 mm-40 -100.55 -35.26 9.58 Favored 'General case' 0 C--O 1.217 -0.657 0 C-N-CA 120.462 -0.495 . . . . 0.0 111.429 -176.103 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.749 HD22 HG23 ' A' ' 27' ' ' ILE . 4.6 mp -82.19 -20.14 38.42 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -177.55 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -79.42 -6.79 88.85 Favored Glycine 0 N--CA 1.44 -1.056 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.571 173.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 38.8 p -125.84 -29.16 3.14 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -176.534 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 41.5 mtt180 -56.85 -52.14 66.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.635 0.255 . . . . 0.0 111.085 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.456 ' OD1' ' HB2' ' A' ' 37' ' ' ARG . 1.8 p30 -154.93 148.96 19.04 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.297 178.893 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.437 ' O ' ' HG2' ' A' ' 40' ' ' MET . 20.5 Cg_exo -66.74 4.5 1.06 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.682 2.922 . . . . 0.0 114.295 -174.749 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.456 ' HB2' ' OD1' ' A' ' 35' ' ' ASP . 54.3 mtm180 -59.21 -34.92 72.73 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 117.77 0.259 . . . . 0.0 111.599 178.541 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -69.2 -17.26 63.77 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 120.899 0.38 . . . . 0.0 110.173 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -102.2 -19.25 15.16 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.725 -179.166 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.437 ' HG2' ' O ' ' A' ' 36' ' ' PRO . 95.7 mmm -64.11 -51.88 61.86 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 172.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.572 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 2.6 p -86.58 114.16 25.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.144 -0.934 . . . . 0.0 109.066 171.678 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -58.4 145.6 37.8 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 122.184 0.993 . . . . 0.0 111.709 -172.487 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -78.67 96.9 5.65 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 114.081 -1.418 . . . . 0.0 112.071 -170.353 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -104.14 99.59 17.64 Favored Pre-proline 0 C--N 1.32 -0.704 0 N-CA-C 107.551 -1.278 . . . . 0.0 107.551 165.206 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -62.47 -24.73 75.59 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 122.354 2.036 . . . . 0.0 113.098 -172.319 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.44 HD22 ' HA ' ' A' ' 46' ' ' LEU . 0.6 OUTLIER -80.62 -39.53 27.3 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 -179.19 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 47' ' ' TRP . . . . . 0.492 ' O ' ' HG2' ' A' ' 51' ' ' MET . 44.4 t90 -74.76 -37.83 62.37 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.403 175.665 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.634 ' HG3' ' CZ ' ' A' ' 9' ' ' PHE . 1.2 mptm? -61.99 -32.27 72.72 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.256 -0.275 . . . . 0.0 110.256 177.637 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 36.3 mttt -77.62 -39.4 45.51 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 120.841 0.353 . . . . 0.0 110.711 175.704 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -64.11 -40.08 95.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.037 0.446 . . . . 0.0 111.266 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.721 ' HE3' ' HG3' ' A' ' 6' ' ' GLU . 12.7 ptm -79.13 -21.33 46.7 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.558 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 22.3 t80 -69.9 -37.15 75.91 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.514 -0.551 . . . . 0.0 109.514 173.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -67.01 -30.91 71.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.133 173.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.464 ' HE2' ' OD1' ' A' ' 58' ' ' ASN . 13.7 tptm -71.72 -38.32 70.51 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.253 176.018 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.45 ' O ' ' HA ' ' A' ' 59' ' ' ARG . 32.4 t80 -65.79 -34.13 77.45 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.602 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 76.0 mt -79.24 -32.04 43.73 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 120.943 -0.303 . . . . 0.0 111.511 -179.25 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.1 p -87.08 -64.0 1.22 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.888 0.375 . . . . 0.0 111.692 178.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.517 ' O ' ' HB2' ' A' ' 59' ' ' ARG . 0.2 OUTLIER -70.45 -47.92 58.36 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.275 -178.214 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.517 ' HB2' ' O ' ' A' ' 58' ' ' ASN . 21.6 mmt180 . . . . . 0 C--O 1.246 0.887 0 O-C-N 123.988 0.805 . . . . 0.0 110.723 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 38.4 ttp . . . . . 0 N--CA 1.448 -0.547 0 CA-C-O 121.308 0.575 . . . . 0.0 109.515 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -62.18 -46.1 90.46 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.087 177.84 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.585 ' CB ' ' HB ' ' A' ' 41' ' ' VAL . . . -63.97 -29.68 70.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.979 -1.009 . . . . 0.0 111.315 -179.434 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.503 ' O ' HG12 ' A' ' 10' ' ' ILE . 12.9 tt0 -60.81 -56.62 19.09 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.417 0.627 . . . . 0.0 110.3 177.209 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.493 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -58.32 -42.57 87.05 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.806 -1.088 . . . . 0.0 111.374 -178.545 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -62.14 -38.59 89.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.203 0.525 . . . . 0.0 110.478 176.062 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.543 ' CZ ' ' HG3' ' A' ' 48' ' ' LYS . 14.6 t80 -64.84 -39.58 93.8 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.084 178.502 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.503 HG12 ' O ' ' A' ' 6' ' ' GLU . 48.1 mm -70.75 -37.77 70.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.138 0.494 . . . . 0.0 110.542 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 35.1 m -68.65 -31.71 71.04 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.332 176.593 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.486 ' SD ' ' HB3' ' A' ' 35' ' ' ASP . 37.8 ttp -71.78 -33.29 68.47 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 177.824 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.673 HD22 HD21 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -71.02 -39.84 72.13 Favored 'General case' 0 N--CA 1.439 -0.977 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.935 178.903 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.0 mtpp -64.67 -35.42 80.98 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.178 0.513 . . . . 0.0 110.611 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.502 ' CD ' HH22 ' A' ' 37' ' ' ARG . 29.7 mt-10 -70.63 -22.84 62.48 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.018 178.466 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -101.98 7.19 41.43 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.415 176.75 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 47.6 mm-40 56.76 31.11 18.86 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 173.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.597 HG11 HD13 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -67.32 143.89 15.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.658 0.742 . . . . 0.0 111.274 -179.969 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.502 ' CG ' ' N ' ' A' ' 20' ' ' SER . 0.0 OUTLIER -148.25 -174.22 4.52 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.848 179.012 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.502 ' N ' ' CG ' ' A' ' 19' ' ' ASP . 4.3 p -58.02 -23.15 53.01 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 120.857 0.36 . . . . 0.0 111.754 -175.384 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.2 p -77.45 -1.4 30.11 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.707 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 4.3 m95 -84.94 144.96 28.0 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.927 0.394 . . . . 0.0 110.398 174.435 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.8 p -102.88 165.78 10.84 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 172.325 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.501 ' CD1' HD12 ' A' ' 27' ' ' ILE . 30.2 t80 -87.21 15.87 5.8 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 122.48 1.133 . . . . 0.0 108.553 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.2 t -91.43 -38.78 12.36 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 106.633 -1.618 . . . . 0.0 106.633 168.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.707 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 36.9 ttt180 -67.44 -34.5 77.33 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.595 176.489 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.737 HG23 HD23 ' A' ' 31' ' ' LEU . 52.0 mt -66.61 -42.08 89.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.644 178.675 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.1 mt -78.64 -33.34 16.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 C-N-CA 119.284 -0.966 . . . . 0.0 111.866 176.472 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.7 p -87.64 -40.58 14.06 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -171.473 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.633 ' O ' ' HD3' ' A' ' 34' ' ' ARG . 26.2 mm-40 -106.82 -36.56 6.63 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 121.279 0.561 . . . . 0.0 110.219 -176.152 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.737 HD23 HG23 ' A' ' 27' ' ' ILE . 11.5 tp -80.22 -36.17 35.19 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.322 -170.241 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.56 -22.34 76.55 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.087 175.439 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 35.5 p -101.57 -28.29 12.61 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 122.425 -0.456 . . . . 0.0 111.731 -178.456 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.633 ' HD3' ' O ' ' A' ' 30' ' ' GLU . 0.5 OUTLIER -63.34 -48.57 77.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.319 179.175 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.496 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 4.8 t70 -139.04 133.92 16.58 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-O 121.056 0.455 . . . . 0.0 111.722 -170.186 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.496 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 17.1 Cg_exo -68.4 -11.81 33.05 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 123.694 2.93 . . . . 0.0 113.158 -179.078 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.506 ' HA ' ' HG2' ' A' ' 40' ' ' MET . 72.2 mtm180 -62.16 -20.95 64.65 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 177.865 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -68.32 -21.71 64.74 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.967 0.413 . . . . 0.0 110.165 176.322 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.443 ' HD1' ' HA ' ' A' ' 36' ' ' PRO . 60.6 m95 -101.86 -17.74 16.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.683 -174.889 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.506 ' HG2' ' HA ' ' A' ' 37' ' ' ARG . 96.7 mmm -55.49 -37.16 67.46 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.234 0.54 . . . . 0.0 110.371 178.815 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.585 ' HB ' ' CB ' ' A' ' 5' ' ' ALA . 6.8 p -99.01 134.4 38.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 171.031 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -59.75 142.34 53.43 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-O 121.486 0.66 . . . . 0.0 109.875 177.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -78.8 98.83 6.45 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.008 -0.997 . . . . 0.0 112.547 -163.161 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -103.65 101.12 22.18 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 114.817 -1.083 . . . . 0.0 108.449 169.625 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -63.0 -26.61 73.94 Favored 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.855 2.37 . . . . 0.0 112.53 -175.056 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.543 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 1.1 tm? -75.75 -39.05 57.8 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' TRP . . . . . 0.482 ' O ' ' HG2' ' A' ' 51' ' ' MET . 45.4 t90 -74.53 -37.06 63.16 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.691 176.246 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.543 ' HG3' ' CZ ' ' A' ' 9' ' ' PHE . 2.3 mptm? -62.07 -32.46 73.0 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.593 -0.443 . . . . 0.0 109.978 175.452 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.559 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 26.9 mttm -72.69 -40.86 65.9 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 120.916 0.388 . . . . 0.0 110.31 174.633 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.543 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 26.5 mt-10 -66.15 -41.88 89.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.309 -178.303 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.482 ' HG2' ' O ' ' A' ' 47' ' ' TRP . 12.5 ptm -76.35 -22.05 55.36 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.86 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.503 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 28.2 t80 -75.26 -37.61 60.87 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.134 -0.484 . . . . 0.0 109.721 175.08 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.559 ' HG2' ' O ' ' A' ' 49' ' ' LYS . 79.0 mm-40 -66.35 -29.1 69.21 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 121.199 0.524 . . . . 0.0 109.634 174.02 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -72.53 -38.43 68.02 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.979 174.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.592 ' CE2' HG13 ' A' ' 18' ' ' VAL . 53.6 t80 -70.72 -23.08 62.38 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.621 -178.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 60.7 mt -93.54 -33.25 13.82 Favored 'General case' 0 N--CA 1.441 -0.896 0 C-N-CA 120.646 -0.422 . . . . 0.0 111.795 179.348 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 45.4 t -87.63 -32.44 19.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.8 0.333 . . . . 0.0 111.103 -178.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -109.45 -58.61 2.02 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.326 -0.397 . . . . 0.0 109.997 -178.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.8 ttm180 . . . . . 0 C--O 1.251 1.171 0 O-C-N 124.254 0.971 . . . . 0.0 110.256 -178.333 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 69.3 mtm . . . . . 0 CA--C 1.52 -0.176 0 CA-C-O 121.23 0.538 . . . . 0.0 109.737 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -65.26 -50.85 64.21 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.952 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 9' ' ' PHE . . . -61.67 -29.76 70.29 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.935 -178.751 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -63.14 -54.12 42.7 Favored 'General case' 0 CA--C 1.509 -0.596 0 CA-C-O 121.354 0.597 . . . . 0.0 110.0 177.095 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.402 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -54.87 -45.64 74.64 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.668 -1.151 . . . . 0.0 111.815 -179.263 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.54 ' O ' ' HG2' ' A' ' 12' ' ' MET . 53.2 mm-40 -68.13 -35.41 78.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.586 0.232 . . . . 0.0 111.228 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.578 ' CZ ' ' HG3' ' A' ' 48' ' ' LYS . 12.6 t80 -64.22 -38.46 91.11 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.759 177.316 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.536 HD11 ' HE3' ' A' ' 54' ' ' LYS . 24.4 mm -65.53 -37.44 80.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.572 0.701 . . . . 0.0 109.82 173.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.659 ' HA ' ' CE ' ' A' ' 14' ' ' LYS . 32.7 m -69.17 -41.39 77.29 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.546 -178.138 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.54 ' HG2' ' O ' ' A' ' 8' ' ' GLU . 15.8 ptm -73.2 -33.52 65.43 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 -179.548 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.518 HD13 HG21 ' A' ' 18' ' ' VAL . 1.7 mm? -68.51 -38.03 80.57 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.578 179.23 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.659 ' CE ' ' HA ' ' A' ' 11' ' ' THR . 0.0 OUTLIER -83.38 -24.18 32.11 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.817 -178.052 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -72.71 -34.57 67.21 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 120.996 0.426 . . . . 0.0 110.87 172.449 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.479 ' OD1' ' HG ' ' A' ' 31' ' ' LEU . 1.0 OUTLIER -79.3 10.16 3.96 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.987 179.953 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 55.06 31.67 16.67 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.225 177.273 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.518 HG21 HD13 ' A' ' 13' ' ' LEU . 53.2 t -75.17 150.14 6.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.602 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.421 ' CG ' ' H ' ' A' ' 20' ' ' SER . 6.9 t70 -168.71 -154.7 0.14 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 171.81 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.421 ' H ' ' CG ' ' A' ' 19' ' ' ASP . 12.3 m -59.69 -27.15 66.17 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -171.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.4 p -83.91 34.77 0.5 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.439 0.638 . . . . 0.0 111.687 -177.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.656 ' CE3' ' HB3' ' A' ' 26' ' ' ARG . 8.9 m95 -133.88 148.35 51.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.044 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 21.7 m -114.01 169.99 8.61 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 169.613 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.514 ' CZ ' ' HB3' ' A' ' 48' ' ' LYS . 42.6 t80 -83.89 16.75 2.65 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 122.03 0.919 . . . . 0.0 110.875 -170.602 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.4 m -93.29 -43.93 8.56 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.096 -1.411 . . . . 0.0 107.995 172.894 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.656 ' HB3' ' CE3' ' A' ' 22' ' ' TRP . 11.8 ttt180 -59.4 -36.35 75.66 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.52 176.295 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.666 HG23 HD22 ' A' ' 31' ' ' LEU . 65.7 mt -64.48 -58.78 5.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.73 177.855 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.2 mt -62.92 -41.31 92.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 119.898 -0.721 . . . . 0.0 111.641 -178.049 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.2 m -78.0 -36.91 48.29 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -175.072 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.57 ' HB2' ' O ' ' A' ' 26' ' ' ARG . 48.1 mm-40 -98.17 -36.82 9.93 Favored 'General case' 0 C--O 1.221 -0.436 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -178.234 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.666 HD22 HG23 ' A' ' 27' ' ' ILE . 5.3 mp -83.96 -28.44 27.78 Favored 'General case' 0 CA--C 1.508 -0.637 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.372 -171.336 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.19 -20.24 66.99 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.563 -0.827 . . . . 0.0 111.472 175.896 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.7 p -108.46 -33.79 6.96 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 178.379 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.48 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 39.9 mtt180 -58.89 -51.29 70.67 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 120.596 0.236 . . . . 0.0 111.141 178.16 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.474 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 6.2 t70 -139.55 129.38 14.13 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-O 121.042 0.449 . . . . 0.0 111.042 -172.856 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.474 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 17.1 Cg_exo -68.76 -8.29 22.95 Favored 'Trans proline' 0 CA--C 1.528 0.183 0 C-N-CA 123.539 2.826 . . . . 0.0 113.036 -178.525 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.63 ' HA ' ' HG3' ' A' ' 40' ' ' MET . 66.1 mtm180 -62.59 -21.57 65.72 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 178.504 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -66.53 -20.08 65.94 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 177.176 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.42 ' HD1' ' HA ' ' A' ' 36' ' ' PRO . 60.5 m95 -97.89 -18.05 18.92 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.443 -0.799 . . . . 0.0 112.082 -174.872 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.63 ' HG3' ' HA ' ' A' ' 37' ' ' ARG . 42.8 mtm -55.63 -49.24 73.37 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.614 0.721 . . . . 0.0 109.605 177.312 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.402 HG21 ' CZ3' ' A' ' 47' ' ' TRP . 4.2 p -99.28 122.67 51.33 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 CA-C-N 114.964 -1.017 . . . . 0.0 108.984 172.504 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -58.36 146.44 34.64 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-O 121.81 0.814 . . . . 0.0 111.166 -174.697 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.408 ' HA ' ' NZ ' ' A' ' 48' ' ' LYS . 15.1 p-10 -68.87 95.43 0.69 Allowed 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 114.349 -1.296 . . . . 0.0 112.104 -168.695 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -102.31 100.44 15.59 Favored Pre-proline 0 N--CA 1.444 -0.738 0 CA-C-N 114.367 -1.288 . . . . 0.0 107.752 169.057 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -60.81 -29.69 88.71 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 122.209 1.939 . . . . 0.0 112.325 -173.516 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 2.6 tm? -73.37 -39.94 64.75 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -178.865 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' TRP . . . . . 0.402 ' CZ3' HG21 ' A' ' 41' ' ' VAL . 42.3 t90 -77.77 -37.56 48.73 Favored 'General case' 0 C--O 1.222 -0.343 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.611 177.222 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.578 ' HG3' ' CZ ' ' A' ' 9' ' ' PHE . 1.4 mptm? -62.38 -31.73 72.44 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 177.26 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.4 mttt -77.92 -40.12 40.67 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.69 0.281 . . . . 0.0 111.019 175.444 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.468 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 27.0 mt-10 -61.86 -46.1 90.9 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.441 0.639 . . . . 0.0 110.664 179.17 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.478 ' SD ' ' CD1' ' A' ' 9' ' ' PHE . 0.7 OUTLIER -71.85 -33.37 68.38 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.712 -177.927 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.458 ' CZ ' HD11 ' A' ' 56' ' ' LEU . 26.1 t80 -70.44 -38.3 74.49 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.513 -178.869 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 50' ' ' GLU . 11.6 pt-20 -72.28 -22.93 61.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.4 0.619 . . . . 0.0 109.818 178.233 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.697 ' HG2' ' HB2' ' A' ' 58' ' ' ASN . 2.7 tmmm? -72.5 -37.15 68.49 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.278 171.051 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.633 ' OH ' ' HA ' ' A' ' 14' ' ' LYS . 54.9 t80 -66.44 -21.95 66.21 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.961 0.41 . . . . 0.0 110.318 176.294 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.458 HD11 ' CZ ' ' A' ' 52' ' ' PHE . 60.8 mt -95.37 -35.33 11.8 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 178.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 44.0 t -88.57 -55.43 3.72 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.12 0.486 . . . . 0.0 110.579 -178.48 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.697 ' HB2' ' HG2' ' A' ' 54' ' ' LYS . 5.6 m120 -77.02 -51.62 10.77 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.348 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.429 HH11 ' HD2' ' A' ' 59' ' ' ARG . 48.7 mtt180 . . . . . 0 C--O 1.248 0.992 0 O-C-N 123.936 0.773 . . . . 0.0 110.629 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.674 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -91.15 59.53 4.01 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.162 0.506 . . . . 0.0 110.726 -178.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.411 ' HB2' ' OE1' ' A' ' 4' ' ' GLU . 69.5 mtm -113.14 -81.21 0.59 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.461 178.443 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.411 ' OE1' ' HB2' ' A' ' 3' ' ' MET . 1.8 mp0 -61.25 -46.52 90.05 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.5 0.667 . . . . 0.0 110.522 -178.49 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.536 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -59.33 -47.36 85.71 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 114.479 -1.237 . . . . 0.0 111.577 -179.295 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -63.33 -47.18 83.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.997 0.427 . . . . 0.0 110.895 -178.123 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -52.31 -54.22 34.24 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.066 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -64.72 -36.46 84.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.273 178.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.629 ' O ' HD23 ' A' ' 13' ' ' LEU . 24.9 t80 -61.41 -37.78 84.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.373 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.7 mm -68.71 -38.65 79.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.131 0.491 . . . . 0.0 110.264 177.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.8 m -69.53 -41.67 75.68 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.573 -177.31 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.509 ' SD ' ' HA ' ' A' ' 9' ' ' PHE . 24.1 ptm -69.11 -26.81 65.1 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 -179.674 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.629 HD23 ' O ' ' A' ' 9' ' ' PHE . 1.3 mm? -69.27 -38.31 78.31 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.36 179.038 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -70.89 -42.33 70.13 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.03 0.443 . . . . 0.0 110.531 174.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -69.34 -28.89 66.62 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.169 -176.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.412 HD22 ' N ' ' A' ' 16' ' ' ASN . 0.9 OUTLIER -85.81 8.65 19.2 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.929 0.395 . . . . 0.0 110.09 175.473 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 59.61 32.5 21.6 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 115.265 -0.879 . . . . 0.0 112.616 175.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.514 HG21 HD13 ' A' ' 13' ' ' LEU . 41.5 t -77.43 141.72 15.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.949 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -154.01 -159.71 1.01 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.95 172.369 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.705 ' HA ' HD22 ' A' ' 56' ' ' LEU . 16.9 m -60.25 -27.01 66.89 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -176.384 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 41.5 p -85.3 45.91 1.23 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 121.181 0.515 . . . . 0.0 111.563 -178.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.583 ' CE2' ' HD3' ' A' ' 26' ' ' ARG . 5.5 m95 -139.61 146.82 40.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.607 -177.54 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 93.7 p -105.12 170.22 8.0 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 170.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.445 ' CE1' ' HB3' ' A' ' 48' ' ' LYS . 61.4 t80 -85.2 15.37 4.28 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 122.133 0.968 . . . . 0.0 109.454 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.9 t -92.75 -41.02 10.36 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 113.859 -1.519 . . . . 0.0 107.335 172.281 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.583 ' HD3' ' CE2' ' A' ' 22' ' ' TRP . 18.1 ttt180 -65.74 -32.86 74.63 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 114.327 -1.306 . . . . 0.0 109.635 177.417 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.7 HG23 HD22 ' A' ' 31' ' ' LEU . 33.4 mt -63.08 -54.46 33.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.198 174.383 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.5 mt -62.37 -32.71 55.9 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 120.411 -0.515 . . . . 0.0 111.893 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 96.9 p -85.51 -37.89 19.17 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -174.121 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.479 ' HB3' ' HE ' ' A' ' 34' ' ' ARG . 40.0 mm-40 -101.56 -35.75 9.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.902 0.382 . . . . 0.0 111.497 -174.34 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.7 HD22 HG23 ' A' ' 27' ' ' ILE . 5.3 mp -86.43 -16.33 37.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.388 0.613 . . . . 0.0 109.662 -174.432 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -81.05 -3.79 90.62 Favored Glycine 0 N--CA 1.442 -0.933 0 CA-C-N 115.199 -0.909 . . . . 0.0 111.904 177.306 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 41.3 p -129.04 -38.25 1.64 Allowed 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -176.184 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.479 ' HE ' ' HB3' ' A' ' 30' ' ' GLU . 89.9 mtt-85 -54.84 -45.63 74.53 Favored 'General case' 0 C--O 1.232 0.174 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -176.486 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.461 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 2.8 p30 -155.92 138.95 10.75 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 172.429 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.497 ' O ' ' HG3' ' A' ' 40' ' ' MET . 16.7 Cg_exo -68.98 14.45 0.2 Allowed 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 123.457 2.771 . . . . 0.0 114.474 -171.842 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 43.3 mtm180 -63.35 -28.72 70.19 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 122.128 -0.357 . . . . 0.0 111.043 177.314 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -68.02 -17.44 64.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.387 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 56.2 m95 -106.95 -24.37 12.04 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.921 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.497 ' HG3' ' O ' ' A' ' 36' ' ' PRO . 89.2 mtp -56.14 -49.89 72.67 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 174.185 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.536 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 2.9 p -86.25 123.37 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.354 -0.839 . . . . 0.0 108.77 169.358 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -58.58 144.32 43.22 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-O 121.729 0.776 . . . . 0.0 111.275 -174.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -73.12 97.32 2.35 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 114.726 -1.124 . . . . 0.0 111.987 -171.124 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -103.05 97.98 10.76 Favored Pre-proline 0 C--N 1.318 -0.766 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 164.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.687 ' O ' ' HB3' ' A' ' 49' ' ' LYS . 17.3 Cg_exo -66.74 -22.21 50.23 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.302 2.001 . . . . 0.0 112.417 -172.51 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.414 HD22 ' HA ' ' A' ' 46' ' ' LEU . 0.3 OUTLIER -82.3 -37.82 25.24 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 179.586 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 45.4 t90 -74.68 -38.75 62.32 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.54 175.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.599 ' HG3' ' CZ ' ' A' ' 9' ' ' PHE . 1.4 mptm? -61.18 -32.41 72.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.035 0.445 . . . . 0.0 110.138 176.528 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.687 ' HB3' ' O ' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -88.59 -33.07 17.8 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.763 -176.493 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -62.9 -47.94 81.12 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.378 0.608 . . . . 0.0 110.257 171.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 1.5 ppp? -71.63 -24.12 61.81 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.032 -176.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.55 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 20.3 t80 -69.25 -36.45 77.16 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.095 174.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -65.9 -28.22 68.78 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.184 0.516 . . . . 0.0 109.943 174.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 10.1 tttm -72.58 -37.15 68.26 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.408 172.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.493 ' HA ' ' HA ' ' A' ' 59' ' ' ARG . 63.5 t80 -72.39 -18.8 61.7 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.125 0.488 . . . . 0.0 110.983 -179.114 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.705 HD22 ' HA ' ' A' ' 20' ' ' SER . 72.9 mt -92.28 -32.63 14.95 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 120.839 0.352 . . . . 0.0 111.073 176.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.3 t -85.68 -48.99 8.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.964 0.411 . . . . 0.0 110.754 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -102.6 -45.24 5.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.904 -179.005 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.493 ' HA ' ' HA ' ' A' ' 55' ' ' TYR . 40.3 ttm180 . . . . . 0 C--O 1.249 1.03 0 CA-C-O 117.957 -1.021 . . . . 0.0 110.733 178.239 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.689 0 N-CA-C 111.71 -0.556 . . . . 0.0 111.71 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.767 ' HB1' ' HB3' ' A' ' 5' ' ' ALA . . . -87.69 74.53 9.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.019 0.438 . . . . 0.0 110.206 -178.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.54 ' O ' ' HG3' ' A' ' 7' ' ' LYS . 26.6 mmt -72.25 -62.5 1.41 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.248 -172.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -68.76 -31.69 70.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.003 0.43 . . . . 0.0 109.963 -178.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.767 ' HB3' ' HB1' ' A' ' 2' ' ' ALA . . . -61.65 -44.47 96.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.723 176.781 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -61.45 -47.32 86.24 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 121.076 0.465 . . . . 0.0 110.466 175.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.54 ' HG3' ' O ' ' A' ' 3' ' ' MET . 48.9 mtpt -55.96 -49.48 73.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.405 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -65.04 -31.16 72.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.851 0.358 . . . . 0.0 110.949 178.083 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.48 ' HE2' ' HE2' ' A' ' 48' ' ' LYS . 1.4 t80 -69.84 -40.21 75.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.94 -179.38 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.5 mm -73.5 -37.16 49.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.185 0.517 . . . . 0.0 110.144 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 26.8 m -65.56 -31.97 73.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.402 176.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 24.0 ttp -75.06 -33.91 61.76 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 115.322 -0.853 . . . . 0.0 108.944 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.487 HD13 HG11 ' A' ' 18' ' ' VAL . 0.2 OUTLIER -68.85 -38.88 80.07 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.835 -179.017 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.4 mppt? -73.89 -32.55 63.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.871 0.367 . . . . 0.0 110.904 177.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -69.2 -20.62 63.98 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.585 176.037 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.408 ' OD1' ' HD3' ' A' ' 34' ' ' ARG . 39.0 m-80 -106.65 17.48 23.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.657 -0.247 . . . . 0.0 111.471 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.1 mm100 53.6 30.98 11.69 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.592 175.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.487 HG11 HD13 ' A' ' 13' ' ' LEU . 58.7 t -68.5 136.84 25.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.742 -177.622 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -148.62 -156.37 0.71 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.8 p -74.37 -15.07 60.94 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.003 -176.081 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.3 t -83.13 -3.45 57.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.412 0.625 . . . . 0.0 110.739 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.56 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 6.0 m95 -92.18 128.32 37.99 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.112 176.121 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 70.8 p -95.71 174.63 6.88 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.49 -0.929 . . . . 0.0 108.49 170.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.529 ' CD1' HD12 ' A' ' 27' ' ' ILE . 27.8 t80 -86.5 15.18 5.74 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.132 178.246 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.8 t -93.23 -33.14 14.09 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 113.897 -1.501 . . . . 0.0 107.211 171.086 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.56 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 31.6 ttt180 -72.58 -33.71 66.94 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.285 176.415 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.574 HG23 HD23 ' A' ' 31' ' ' LEU . 45.8 mt -65.12 -39.13 84.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.509 176.048 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 72.8 mt -76.27 -44.0 36.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 C-N-CA 119.594 -0.842 . . . . 0.0 111.572 173.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 99.0 p -74.38 -38.07 63.26 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -171.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.543 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 50.2 mm-40 -109.96 -37.64 5.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.224 0.535 . . . . 0.0 111.226 -177.08 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.574 HD23 HG23 ' A' ' 27' ' ' ILE . 11.6 tp -87.84 -12.78 43.91 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.857 -162.47 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -83.28 -15.68 71.13 Favored Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.47 -0.872 . . . . 0.0 111.719 176.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.4 p -120.28 -26.96 5.34 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.543 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 46.5 mtt180 -57.12 -40.01 76.23 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.618 0.247 . . . . 0.0 111.104 178.815 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.494 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 8.8 t70 -152.58 129.89 5.79 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.412 179.734 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.494 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 22.3 Cg_exo -66.37 -0.89 4.74 Favored 'Trans proline' 0 CA--C 1.531 0.357 0 C-N-CA 123.658 2.905 . . . . 0.0 113.824 -177.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.449 ' HE ' ' CG ' ' A' ' 35' ' ' ASP . 68.2 mtm180 -61.36 -21.27 63.88 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 175.534 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -68.07 -18.67 64.74 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.221 0.534 . . . . 0.0 109.795 175.398 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 53.5 m95 -104.35 -17.29 14.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.409 -176.64 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 32.6 tpp -60.84 -38.55 85.86 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 121.243 0.544 . . . . 0.0 109.564 176.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.655 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 7.2 p -93.61 139.36 18.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.123 171.355 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -64.6 145.69 55.79 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-O 121.727 0.775 . . . . 0.0 111.778 -176.429 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -68.39 96.68 0.69 Allowed 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.155 -1.384 . . . . 0.0 112.051 -171.437 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.506 ' O ' ' HD3' ' A' ' 48' ' ' LYS . 9.8 t70 -122.24 98.31 44.43 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 114.877 -1.056 . . . . 0.0 108.623 169.074 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -60.52 -32.49 93.65 Favored 'Trans proline' 0 CA--C 1.516 -0.409 0 C-N-CA 122.937 2.425 . . . . 0.0 112.758 -174.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.68 -38.35 58.77 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.952 -178.036 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' TRP . . . . . 0.542 ' CZ3' HG21 ' A' ' 41' ' ' VAL . 71.2 t90 -73.2 -36.6 66.55 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.896 -0.321 . . . . 0.0 110.147 174.824 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.506 ' HD3' ' O ' ' A' ' 44' ' ' ASP . 2.3 mptm? -61.07 -34.1 74.37 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.717 -0.393 . . . . 0.0 109.944 176.227 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.486 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 33.3 mttt -78.72 -40.66 32.97 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 120.875 0.369 . . . . 0.0 110.59 178.329 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -65.96 -43.41 88.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.414 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 2.8 ppp? -73.28 -29.02 62.44 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 -178.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -69.79 -37.95 76.51 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.423 176.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.486 ' HG3' ' O ' ' A' ' 49' ' ' LYS . 92.5 mt-10 -69.6 -26.5 64.48 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 175.258 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 40.8 tptt -72.98 -37.52 67.0 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.224 0.535 . . . . 0.0 109.618 174.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.439 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 80.1 t80 -63.18 -30.4 71.55 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.684 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 64.6 mt -89.97 -32.83 16.62 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.408 179.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.4 t -79.79 -48.71 13.13 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.878 0.37 . . . . 0.0 111.466 -178.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -100.79 -45.76 5.36 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.547 -176.106 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 55' ' ' TYR . 3.1 mmt180 . . . . . 0 C--O 1.249 1.066 0 O-C-N 123.89 0.744 . . . . 0.0 110.751 176.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.51 0 N-CA-C 111.942 -0.463 . . . . 0.0 111.942 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 58.05 28.95 17.05 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 123.409 0.683 . . . . 0.0 112.089 178.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 68.8 mtm -83.25 -54.05 5.3 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 121.067 -0.253 . . . . 0.0 110.886 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -57.07 -42.98 81.64 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.402 0.62 . . . . 0.0 109.934 175.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.603 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -60.43 -47.29 86.75 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 114.746 -1.115 . . . . 0.0 111.129 178.57 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -59.15 -49.71 76.84 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.107 0.479 . . . . 0.0 110.395 178.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.403 ' HD2' ' HA ' ' A' ' 7' ' ' LYS . 12.9 mmmm -54.54 -44.85 73.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.945 -179.262 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.453 ' HB3' ' HD3' ' A' ' 37' ' ' ARG . 40.9 mt-10 -75.88 -25.53 56.22 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.036 179.421 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -72.31 -39.9 67.9 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.828 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.624 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 39.2 mm -68.57 -38.73 79.52 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.222 0 CA-C-O 121.389 0.614 . . . . 0.0 109.939 177.339 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.0 m -67.62 -29.68 69.06 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.049 176.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 42.7 ttp -77.24 -29.43 54.07 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.334 -178.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.537 HD13 HG11 ' A' ' 18' ' ' VAL . 0.2 OUTLIER -71.21 -38.58 72.03 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.733 179.367 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.624 ' HD3' ' O ' ' A' ' 10' ' ' ILE . 0.3 OUTLIER -74.38 -31.89 62.54 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.691 176.775 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -63.43 -32.09 73.43 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.354 175.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -98.15 10.28 40.9 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.485 -177.444 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 55.4 mm-40 58.11 31.92 21.34 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.911 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.537 HG11 HD13 ' A' ' 13' ' ' LEU . 65.1 t -69.92 123.31 23.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.617 -176.19 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -142.07 -159.45 0.97 Allowed 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 170.205 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.5 t -59.02 -17.32 24.09 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -176.423 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.2 t -77.67 -3.78 42.79 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 122.133 -0.354 . . . . 0.0 111.414 178.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.522 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 7.8 m95 -99.43 138.1 37.0 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.234 176.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 87.7 p -110.5 178.91 4.23 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 170.586 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.536 ' CD1' HD12 ' A' ' 27' ' ' ILE . 15.9 t80 -86.14 16.69 4.1 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.999 0.904 . . . . 0.0 109.272 178.713 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.7 t -93.48 -38.18 11.55 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 169.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.522 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 29.3 ttt180 -71.56 -33.32 69.01 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 114.049 -1.432 . . . . 0.0 109.166 177.785 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.571 HG12 HD22 ' A' ' 31' ' ' LEU . 29.3 mt -64.92 -50.24 75.97 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.391 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.121 173.669 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 24' ' ' PHE . 44.6 mm -62.59 -43.19 98.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 119.822 -0.751 . . . . 0.0 111.198 177.631 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 48.4 t -70.58 -38.59 74.08 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -176.162 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.507 ' HB3' ' HE ' ' A' ' 34' ' ' ARG . 20.4 mm-40 -113.83 -34.95 5.29 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -171.196 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.571 HD22 HG12 ' A' ' 27' ' ' ILE . 0.5 OUTLIER -87.65 -26.36 23.06 Favored 'General case' 0 C--N 1.319 -0.754 0 O-C-N 121.771 -0.581 . . . . 0.0 111.01 -175.106 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -86.1 9.19 70.5 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.707 -0.759 . . . . 0.0 111.518 175.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 46.0 p -132.02 -54.0 0.98 Allowed 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -177.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.507 ' HE ' ' HB3' ' A' ' 30' ' ' GLU . 65.9 mtt-85 -52.87 -46.06 67.74 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -177.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.503 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 9.3 t70 -139.21 132.84 15.86 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.999 -171.071 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.503 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 17.3 Cg_exo -68.29 -2.21 8.6 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 123.32 2.68 . . . . 0.0 113.35 -178.732 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.474 ' HE ' ' CG ' ' A' ' 35' ' ' ASP . 48.0 mtm180 -56.13 -30.32 61.96 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 176.321 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.403 ' CE1' ' HD2' ' A' ' 48' ' ' LYS . 67.7 t80 -69.5 -21.76 63.65 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.767 0.318 . . . . 0.0 110.393 178.359 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 62.6 m95 -104.08 -19.98 13.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.93 -174.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.455 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 38.2 mtm -60.8 -39.64 89.66 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.474 0.654 . . . . 0.0 109.559 177.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.603 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 5.2 p -88.38 130.65 37.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.102 -0.953 . . . . 0.0 108.664 169.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.23 136.74 58.05 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-O 121.447 0.642 . . . . 0.0 109.637 178.061 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.407 ' O ' ' HD3' ' A' ' 45' ' ' PRO . 29.5 t70 -75.88 96.47 3.72 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 114.882 -1.053 . . . . 0.0 112.091 -166.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -100.84 95.91 5.02 Favored Pre-proline 0 C--N 1.321 -0.643 0 N-CA-C 107.113 -1.439 . . . . 0.0 107.113 165.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.661 ' HA ' ' HB2' ' A' ' 48' ' ' LYS . 19.4 Cg_exo -67.11 -23.56 45.8 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 122.421 2.08 . . . . 0.0 112.107 -171.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -71.24 -38.32 71.95 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 56.4 t90 -75.72 -38.27 58.7 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 172.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.661 ' HB2' ' HA ' ' A' ' 45' ' ' PRO . 27.0 mmtp -61.01 -35.81 77.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.328 179.171 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.531 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 43.8 mttt -80.38 -40.29 26.81 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.669 179.58 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -66.14 -37.95 86.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.321 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 1.3 ppp? -71.73 -32.85 68.18 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.497 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 35.6 t80 -71.01 -37.96 72.65 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.665 176.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.531 ' HG2' ' O ' ' A' ' 49' ' ' LYS . 24.2 mm-40 -66.51 -30.84 71.25 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 175.522 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -72.45 -37.96 68.4 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.2 178.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.685 ' HA ' ' HA ' ' A' ' 59' ' ' ARG . 75.7 t80 -70.98 -24.51 62.41 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.75 -177.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 82.8 mt -87.95 -34.02 18.24 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.791 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.6 p -86.35 -41.11 14.79 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.952 0.406 . . . . 0.0 111.407 -178.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -118.13 -42.17 2.82 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.163 -176.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.685 ' HA ' ' HA ' ' A' ' 55' ' ' TYR . 39.0 ttm180 . . . . . 0 C--O 1.247 0.943 0 CA-C-O 118.123 -0.942 . . . . 0.0 110.378 -177.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.701 0 N-CA-C 111.978 -0.449 . . . . 0.0 111.978 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 58.42 24.15 11.43 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 176.047 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.489 ' O ' ' HG2' ' A' ' 7' ' ' LYS . 34.4 mmt -87.33 -46.13 9.96 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 122.249 -0.282 . . . . 0.0 110.336 -178.257 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -68.15 -35.0 77.36 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 176.006 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.501 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -64.25 -41.21 97.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.388 175.33 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.512 ' O ' HG12 ' A' ' 10' ' ' ILE . 29.8 tt0 -57.39 -47.03 82.74 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.038 176.572 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.565 ' HE2' ' N ' ' A' ' 7' ' ' LYS . 9.4 mmpt? -52.5 -52.35 54.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.446 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -62.78 -39.02 92.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.551 178.167 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.525 ' CE2' ' HG3' ' A' ' 48' ' ' LYS . 16.2 t80 -63.11 -39.48 94.81 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.465 -178.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.595 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 47.4 mm -74.31 -37.11 44.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.183 0.516 . . . . 0.0 110.226 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 29.9 m -64.11 -34.82 78.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.597 0.713 . . . . 0.0 110.289 176.386 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 33.4 ttp -75.93 -30.68 58.8 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.281 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.452 HD13 HG11 ' A' ' 18' ' ' VAL . 0.1 OUTLIER -70.36 -38.41 74.77 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.042 179.128 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.595 ' HD3' ' O ' ' A' ' 10' ' ' ILE . 0.0 OUTLIER -72.18 -33.48 67.7 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.756 0.313 . . . . 0.0 110.485 176.258 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -66.19 -26.76 67.55 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 121.288 0.566 . . . . 0.0 111.511 176.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 -102.02 14.57 31.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.785 -177.275 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 53.95 31.42 13.39 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.849 175.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.452 HG11 HD13 ' A' ' 13' ' ' LEU . 66.4 t -67.12 136.06 27.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.245 0.545 . . . . 0.0 111.634 -173.082 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -157.94 -160.21 0.89 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.349 175.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 p -55.51 -24.39 31.47 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 123.383 0.427 . . . . 0.0 112.098 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.6 p -69.96 -11.17 60.67 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 120.972 0.415 . . . . 0.0 112.0 -179.189 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.579 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 11.5 m95 -95.75 133.83 39.39 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.169 0.509 . . . . 0.0 110.969 179.099 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 m -105.86 168.54 9.05 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 168.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.583 ' CD1' HD12 ' A' ' 27' ' ' ILE . 18.9 t80 -82.5 15.78 2.39 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 122.087 0.946 . . . . 0.0 109.912 -176.261 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.6 t -92.84 -34.3 13.89 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.173 -1.376 . . . . 0.0 107.674 170.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.579 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 40.8 ttt180 -70.14 -36.14 74.56 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.618 -1.174 . . . . 0.0 108.99 178.045 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.61 HG23 HD23 ' A' ' 31' ' ' LEU . 52.4 mt -64.77 -47.14 89.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.334 176.727 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.6 mt -70.51 -42.79 78.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 C-N-CA 119.546 -0.861 . . . . 0.0 111.705 177.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.3 t -77.55 -39.02 47.35 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -171.042 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 22.9 mm-40 -111.52 -35.39 5.81 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 121.077 0.465 . . . . 0.0 111.345 -174.362 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.61 HD23 HG23 ' A' ' 27' ' ' ILE . 11.4 tp -84.87 -36.67 21.39 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.478 -168.741 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -68.07 -17.42 69.83 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.763 174.261 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 65.1 p -107.1 -1.9 21.54 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 122.452 -0.44 . . . . 0.0 111.564 -178.736 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 60.3 mtt-85 -88.99 -47.37 8.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.542 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.495 ' OD1' ' HG3' ' A' ' 37' ' ' ARG . 11.8 t70 -149.32 137.41 11.71 Favored Pre-proline 0 C--N 1.325 -0.469 0 C-N-CA 120.904 -0.319 . . . . 0.0 111.222 -172.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.521 ' HA ' ' HD1' ' A' ' 39' ' ' TRP . 34.2 Cg_exo -63.32 -7.02 11.15 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.681 2.92 . . . . 0.0 113.959 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.495 ' HG3' ' OD1' ' A' ' 35' ' ' ASP . 47.0 mtm180 -56.41 -28.79 60.4 Favored 'General case' 0 CA--C 1.529 0.146 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 174.878 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -71.96 -20.27 61.76 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.816 0.341 . . . . 0.0 110.686 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.521 ' HD1' ' HA ' ' A' ' 36' ' ' PRO . 56.7 m95 -106.81 -23.53 12.36 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.436 -175.763 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 39.3 ttm -51.91 -47.3 64.68 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 121.36 0.6 . . . . 0.0 109.951 175.473 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.501 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 2.5 p -87.43 116.67 30.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 167.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -58.19 145.42 37.23 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 121.464 0.649 . . . . 0.0 110.98 -173.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -63.33 98.09 0.15 Allowed 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.25 -1.341 . . . . 0.0 113.909 -164.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -111.11 95.94 27.65 Favored Pre-proline 0 N--CA 1.426 -1.628 0 CA-C-N 113.121 -1.854 . . . . 0.0 108.97 166.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_exo -67.71 -32.87 29.28 Favored 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 122.663 2.242 . . . . 0.0 112.662 -173.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.681 ' HA ' ' HE3' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -70.63 -36.39 73.44 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.881 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 47' ' ' TRP . . . . . 0.496 ' O ' ' HG2' ' A' ' 51' ' ' MET . 39.6 t90 -74.2 -39.27 63.26 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 119.608 -0.837 . . . . 0.0 110.111 175.898 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.525 ' HG3' ' CE2' ' A' ' 9' ' ' PHE . 0.0 OUTLIER -63.83 -32.77 74.39 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 176.312 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.681 ' HE3' ' HA ' ' A' ' 46' ' ' LEU . 12.0 ptpt -78.72 -38.59 38.62 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.136 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -68.52 -42.03 79.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.642 179.534 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.496 ' HG2' ' O ' ' A' ' 47' ' ' TRP . 15.6 ptm -74.22 -26.65 60.38 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.54 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 39.8 t80 -70.33 -37.15 74.63 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-N 115.938 -0.573 . . . . 0.0 109.605 175.03 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -66.57 -30.85 71.25 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.941 175.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -72.85 -37.39 67.43 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-O 121.353 0.597 . . . . 0.0 109.904 177.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.437 ' HE2' ' O ' ' A' ' 18' ' ' VAL . 75.1 t80 -71.49 -24.71 62.03 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.643 -178.094 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 40.2 mt -93.7 -33.47 13.63 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.369 178.585 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 21.2 t -100.06 25.06 7.8 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.36 0.6 . . . . 0.0 110.664 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -171.11 -66.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.051 177.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.426 ' HB2' ' O ' ' A' ' 55' ' ' TYR . 36.6 ttm180 . . . . . 0 C--O 1.249 1.038 0 O-C-N 124.333 1.02 . . . . 0.0 109.543 -172.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.703 0 N-CA-C 111.967 -0.453 . . . . 0.0 111.967 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 63.23 26.49 15.21 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 122.956 0.502 . . . . 0.0 111.343 178.313 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 18.6 ttt -67.5 -50.77 57.43 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 121.583 0.706 . . . . 0.0 110.007 179.366 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -62.7 -44.04 97.26 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.028 178.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.674 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -60.31 -45.03 94.81 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.24 177.737 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.452 ' O ' HG12 ' A' ' 10' ' ' ILE . 29.2 tt0 -57.34 -54.39 47.38 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 121.131 0.491 . . . . 0.0 110.254 177.115 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.1 ttpt -50.15 -50.35 49.19 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.009 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -61.09 -40.18 92.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.046 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.62 ' CZ ' ' HG3' ' A' ' 48' ' ' LYS . 25.4 t80 -67.38 -40.1 85.68 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.91 -177.096 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.453 HG22 ' HE3' ' A' ' 14' ' ' LYS . 40.1 mm -74.88 -36.34 38.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.28 0.562 . . . . 0.0 110.284 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.4 m -71.38 -28.11 63.8 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.406 177.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.482 ' SD ' ' HB3' ' A' ' 35' ' ' ASP . 27.2 ttp -74.47 -34.6 63.16 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 177.732 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.437 HD13 HG11 ' A' ' 18' ' ' VAL . 0.1 OUTLIER -68.59 -38.03 80.31 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.04 178.396 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.453 ' HE3' HG22 ' A' ' 10' ' ' ILE . 33.6 mttt -68.81 -43.15 76.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.205 0.526 . . . . 0.0 111.04 176.504 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -66.08 -29.64 70.01 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.025 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -91.68 11.19 25.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.657 0.265 . . . . 0.0 111.087 177.134 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 55.29 31.84 17.43 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.535 176.339 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.437 HG11 HD13 ' A' ' 13' ' ' LEU . 58.7 t -65.73 130.04 30.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.405 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -140.87 -164.15 1.68 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.429 176.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.2 p -56.21 -28.31 57.85 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -178.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 79.6 p -75.39 -6.77 51.7 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.027 0.441 . . . . 0.0 111.999 -176.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.747 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 9.8 m95 -89.38 126.08 35.4 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.112 0.482 . . . . 0.0 111.442 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.433 ' C ' ' H ' ' A' ' 25' ' ' SER . 30.4 t -83.89 155.65 22.79 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 167.54 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.576 ' CZ ' ' HB3' ' A' ' 48' ' ' LYS . 91.0 t80 -81.0 15.35 1.87 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-O 122.709 1.242 . . . . 0.0 109.356 -179.026 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.433 ' H ' ' C ' ' A' ' 23' ' ' SER . 15.1 t -92.28 -30.72 15.71 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 113.136 -1.847 . . . . 0.0 107.366 171.342 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.747 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 62.7 ttt180 -73.49 -37.63 65.66 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 114.478 -1.237 . . . . 0.0 109.59 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.55 ' O ' ' HB2' ' A' ' 31' ' ' LEU . 64.5 mt -63.12 -52.33 60.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.615 175.207 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 76.6 mt -61.11 -42.16 92.15 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 120.069 -0.652 . . . . 0.0 111.27 178.389 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.2 t -77.97 -39.13 43.51 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -172.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.578 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 12.8 mt-10 -107.33 -37.07 6.34 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.973 -0.691 . . . . 0.0 111.993 -176.339 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.55 ' HB2' ' O ' ' A' ' 27' ' ' ILE . 1.2 mp -78.13 -31.11 49.69 Favored 'General case' 0 C--N 1.323 -0.566 0 O-C-N 122.025 -0.422 . . . . 0.0 111.315 -172.034 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.11 -32.84 67.82 Favored Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.546 176.128 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.7 t -104.32 -19.39 14.1 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -178.039 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.578 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 62.2 mtt-85 -74.63 -34.39 62.77 Favored 'General case' 0 CA--C 1.517 -0.302 0 O-C-N 122.316 -0.24 . . . . 0.0 111.628 179.216 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.482 ' HB3' ' SD ' ' A' ' 12' ' ' MET . 8.7 t0 -147.76 129.78 7.53 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-O 120.994 0.426 . . . . 0.0 111.087 -175.397 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 16.9 Cg_exo -68.71 -6.0 16.81 Favored 'Trans proline' 0 CA--C 1.529 0.251 0 C-N-CA 123.363 2.708 . . . . 0.0 112.795 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.548 ' HA ' ' HG2' ' A' ' 40' ' ' MET . 51.9 mtt180 -61.69 -25.08 67.18 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.625 0.231 . . . . 0.0 111.625 176.386 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -68.13 -21.64 64.92 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 176.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 48.6 m95 -99.36 -17.13 18.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.485 -177.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.548 ' HG2' ' HA ' ' A' ' 37' ' ' ARG . 86.2 mmm -49.61 -38.62 32.52 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.317 0.579 . . . . 0.0 110.564 175.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.674 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 3.5 p -113.07 129.95 67.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.084 173.075 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.45 143.12 50.8 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-O 121.45 0.643 . . . . 0.0 109.714 177.617 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.464 ' O ' ' HD3' ' A' ' 45' ' ' PRO . 25.6 t0 -76.79 99.31 5.09 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.05 -0.977 . . . . 0.0 113.153 -160.635 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -96.22 99.26 5.01 Favored Pre-proline 0 C--N 1.324 -0.536 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 166.145 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.464 ' HD3' ' O ' ' A' ' 43' ' ' ASP . 37.6 Cg_exo -62.38 -30.32 80.48 Favored 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 122.934 2.423 . . . . 0.0 112.765 -174.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.461 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 1.1 tm? -71.18 -39.03 72.1 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.219 -0.659 . . . . 0.0 109.219 -179.177 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' TRP . . . . . 0.455 ' O ' ' HG2' ' A' ' 51' ' ' MET . 42.5 t90 -75.2 -38.53 60.7 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.454 176.725 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.62 ' HG3' ' CZ ' ' A' ' 9' ' ' PHE . 2.1 mptm? -62.83 -33.99 76.39 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.628 177.616 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.426 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 33.4 mttt -75.37 -38.75 59.83 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.477 176.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.461 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 32.3 mt-10 -62.37 -47.48 84.0 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.264 177.514 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.455 ' HG2' ' O ' ' A' ' 47' ' ' TRP . 13.5 ptm -73.13 -22.74 60.47 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.098 -176.667 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.505 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 24.0 t80 -76.97 -38.43 53.26 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.53 176.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 49' ' ' LYS . 47.2 mm-40 -67.31 -33.83 76.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.924 0.393 . . . . 0.0 110.019 176.682 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.2 tttt -72.32 -37.73 68.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.866 175.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -61.85 -31.75 72.04 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.52 178.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 83.1 mt -84.15 -33.28 24.29 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -178.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 72.4 p -106.26 9.16 32.13 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -175.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.48 ' O ' ' HB2' ' A' ' 59' ' ' ARG . 0.2 OUTLIER -153.09 -49.79 0.1 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.741 -0.209 . . . . 0.0 110.498 -176.759 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.48 ' HB2' ' O ' ' A' ' 58' ' ' ASN . 50.9 mtt180 . . . . . 0 C--O 1.247 0.931 0 O-C-N 124.113 0.883 . . . . 0.0 110.168 -178.296 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.738 0 N-CA-C 112.104 -0.398 . . . . 0.0 112.104 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -86.84 22.25 2.03 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.85 0.357 . . . . 0.0 111.429 -175.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.427 ' O ' ' HG3' ' A' ' 7' ' ' LYS . 65.0 mtm -106.89 -62.09 1.45 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.16 0.505 . . . . 0.0 109.997 177.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -58.49 -56.56 20.61 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.963 -175.049 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.604 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -64.67 -34.44 78.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.647 -176.174 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.769 ' HG3' ' HE3' ' A' ' 51' ' ' MET . 34.6 tt0 -62.99 -52.87 61.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.898 0.38 . . . . 0.0 110.025 178.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.427 ' HG3' ' O ' ' A' ' 3' ' ' MET . 45.8 mtpt -64.33 -35.91 82.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.689 -179.269 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -61.66 -37.78 85.33 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.938 0.399 . . . . 0.0 110.185 174.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.572 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 30.3 t80 -71.43 -39.28 71.15 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.32 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 6' ' ' GLU . 47.5 mm -71.39 -37.7 66.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.281 0.562 . . . . 0.0 110.399 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 38.9 m -72.77 -24.37 60.94 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.193 175.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.761 ' HB2' ' HD2' ' A' ' 37' ' ' ARG . 46.7 ttp -75.18 -33.14 61.41 Favored 'General case' 0 CA--C 1.509 -0.611 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 178.67 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 9' ' ' PHE . 80.1 mt -68.06 -38.3 82.3 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.108 176.354 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 62.7 mttt -69.55 -40.38 76.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.256 0.551 . . . . 0.0 111.039 176.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -73.97 -13.32 60.86 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.823 179.232 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.544 ' OD1' ' HD2' ' A' ' 34' ' ' ARG . 0.9 OUTLIER -106.66 10.82 30.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.841 0.353 . . . . 0.0 110.644 177.546 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 41.9 mm-40 56.37 31.83 19.43 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.014 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.481 HG11 HD22 ' A' ' 13' ' ' LEU . 58.3 t -75.71 140.95 16.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.786 -178.32 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -157.94 -158.81 0.76 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.026 -0.533 . . . . 0.0 109.597 172.227 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.7 p -51.23 -32.25 23.52 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.1 t -85.32 25.86 0.96 Allowed 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.42 0.628 . . . . 0.0 111.88 -174.154 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.675 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 3.6 m95 -115.89 140.73 48.95 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.955 0.407 . . . . 0.0 110.873 178.625 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 84.9 p -97.08 168.49 10.42 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 173.19 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.472 ' CD1' HD12 ' A' ' 27' ' ' ILE . 41.7 t80 -89.04 15.75 8.19 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 122.172 0.987 . . . . 0.0 108.957 177.081 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.0 m -94.14 -42.9 8.74 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 113.842 -1.526 . . . . 0.0 107.462 170.543 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.675 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 19.7 ttt180 -60.58 -38.05 83.32 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 113.57 -1.65 . . . . 0.0 109.437 174.431 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.776 HG23 HD22 ' A' ' 31' ' ' LEU . 50.7 mt -61.15 -58.25 8.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.64 175.223 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 71.3 mt -60.18 -34.78 58.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.543 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.4 t -79.24 -38.85 34.61 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -174.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 26.8 mm-40 -104.05 -34.55 8.39 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 -173.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.776 HD22 HG23 ' A' ' 27' ' ' ILE . 5.1 mp -86.47 -15.06 41.33 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.434 0.635 . . . . 0.0 109.725 -176.015 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -83.34 -5.53 88.67 Favored Glycine 0 N--CA 1.439 -1.108 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.275 174.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 23.7 p -128.02 -45.44 1.41 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -175.129 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.544 ' HD2' ' OD1' ' A' ' 16' ' ' ASN . 47.1 mtt180 -53.5 -44.86 69.4 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -177.4 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.441 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 16.6 t70 -160.34 129.44 3.15 Favored Pre-proline 0 C--N 1.323 -0.559 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 177.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.505 ' O ' ' HG3' ' A' ' 40' ' ' MET . 16.3 Cg_exo -69.46 27.56 0.17 Allowed 'Trans proline' 0 CA--C 1.533 0.438 0 C-N-CA 123.577 2.852 . . . . 0.0 114.851 -171.241 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.761 ' HD2' ' HB2' ' A' ' 12' ' ' MET . 87.1 mtt180 -65.5 -28.42 69.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.122 0.487 . . . . 0.0 110.142 176.564 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.429 ' CE1' ' HD2' ' A' ' 48' ' ' LYS . 49.9 t80 -69.26 -20.57 63.93 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.461 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 46.4 m95 -103.63 -28.64 11.59 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.524 -175.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.581 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 47.9 mtm -55.56 -41.5 73.37 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.178 0.514 . . . . 0.0 110.207 178.674 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.604 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 3.4 p -89.91 123.08 41.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 169.5 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -58.86 143.8 46.41 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-O 121.68 0.752 . . . . 0.0 110.671 -176.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -75.37 98.29 3.82 Favored 'General case' 0 N--CA 1.436 -1.129 0 CA-C-N 114.667 -1.151 . . . . 0.0 113.594 -163.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -106.0 95.97 11.99 Favored Pre-proline 0 C--N 1.317 -0.818 0 N-CA-C 106.868 -1.531 . . . . 0.0 106.868 158.041 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.852 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 25.9 Cg_exo -62.68 -37.37 57.45 Favored 'Trans proline' 0 N--CA 1.449 -1.147 0 C-N-CA 121.997 1.798 . . . . 0.0 111.997 -173.399 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.484 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -61.4 -38.75 88.22 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.228 -179.822 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 48.4 t90 -69.25 -38.34 78.41 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-O 120.875 0.369 . . . . 0.0 110.038 173.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.429 ' HD2' ' CE1' ' A' ' 38' ' ' TYR . 23.4 mmtp -60.6 -33.36 72.62 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.363 177.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.852 ' HG3' ' O ' ' A' ' 45' ' ' PRO . 31.7 mtpt -82.54 -38.44 23.74 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.236 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 42.9 mt-10 -61.84 -39.02 90.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.285 0.564 . . . . 0.0 111.271 176.749 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.769 ' HE3' ' HG3' ' A' ' 6' ' ' GLU . 17.6 ptm -78.79 -26.96 44.45 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-O 121.217 0.532 . . . . 0.0 109.767 -178.421 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.517 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 33.7 t80 -71.36 -39.28 71.39 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.155 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -74.39 -22.16 59.31 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.546 0.689 . . . . 0.0 109.464 177.257 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.7 tptm -71.09 -37.51 72.42 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.49 172.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -68.16 -25.84 65.46 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.628 178.22 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 58.7 mt -86.43 -32.53 20.82 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.309 178.602 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -89.91 -49.21 6.74 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.131 0.491 . . . . 0.0 110.961 -177.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -86.36 -56.29 3.51 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.74 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 . . . . . 0 C--O 1.247 0.935 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.575 -179.522 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.662 0 N-CA-C 112.134 -0.386 . . . . 0.0 112.134 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.65 40.94 1.14 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.928 0.394 . . . . 0.0 111.002 -177.086 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 29.6 ttp -74.92 -46.31 36.7 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.12 0.486 . . . . 0.0 110.081 -179.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -66.37 -44.51 82.93 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.846 178.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.429 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -60.03 -42.15 93.76 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.582 176.881 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -57.97 -46.71 84.7 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.798 177.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.484 ' HE2' ' HA ' ' A' ' 7' ' ' LYS . 5.8 mmpt? -48.72 -57.7 5.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.341 179.298 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.486 ' HB3' ' HD2' ' A' ' 37' ' ' ARG . 28.2 mt-10 -73.4 -29.85 62.87 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.53 -178.337 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.583 ' HE2' ' HE2' ' A' ' 48' ' ' LYS . 0.4 OUTLIER -58.98 -40.62 85.36 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 177.81 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.537 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 33.4 mm -71.56 -37.08 62.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.339 0.59 . . . . 0.0 110.354 177.7 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 23.1 m -64.2 -40.8 96.82 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.301 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.471 ' HG2' ' O ' ' A' ' 8' ' ' GLU . 16.4 ptm -75.68 -23.63 56.23 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -177.533 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 9' ' ' PHE . 85.2 mt -68.77 -39.89 79.98 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.628 174.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.537 ' HD3' ' O ' ' A' ' 10' ' ' ILE . 0.1 OUTLIER -71.56 -39.78 70.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.394 0.616 . . . . 0.0 110.422 177.126 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -75.45 -14.17 60.42 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.597 -0.729 . . . . 0.0 112.546 -175.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.431 ' HA ' HD22 ' A' ' 16' ' ' ASN . 0.8 OUTLIER -107.87 20.18 19.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.834 0.35 . . . . 0.0 110.928 176.274 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 59.79 31.64 20.91 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.339 175.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.493 HG22 ' CE2' ' A' ' 22' ' ' TRP . 51.6 t -78.15 128.85 38.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.029 0.442 . . . . 0.0 111.264 -177.361 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -150.34 -157.46 0.82 Allowed 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 171.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.8 m -65.46 -9.02 22.07 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.5 p -79.06 -16.92 56.11 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 121.019 0.438 . . . . 0.0 111.199 176.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.597 ' CE2' ' HD3' ' A' ' 26' ' ' ARG . 7.2 m95 -86.86 119.69 27.35 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.281 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.401 ' C ' ' H ' ' A' ' 25' ' ' SER . 5.5 m -83.93 165.49 18.64 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 168.574 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.563 ' CD1' HD12 ' A' ' 27' ' ' ILE . 29.3 t80 -82.46 16.48 2.08 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 122.454 1.121 . . . . 0.0 109.577 -175.004 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.401 ' H ' ' C ' ' A' ' 23' ' ' SER . 48.1 t -91.4 -31.59 15.97 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-N 113.673 -1.603 . . . . 0.0 107.452 172.165 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.597 ' HD3' ' CE2' ' A' ' 22' ' ' TRP . 28.7 ttt180 -75.05 -33.32 61.71 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.846 179.0 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.563 HD12 ' CD1' ' A' ' 24' ' ' PHE . 54.2 mt -66.15 -42.3 90.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.175 176.736 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.6 mt -74.58 -43.36 48.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 119.561 -0.855 . . . . 0.0 111.808 175.363 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.2 t -82.4 -38.87 23.47 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -169.429 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.815 ' O ' ' HB2' ' A' ' 34' ' ' ARG . 28.9 mm-40 -103.89 -35.77 8.03 Favored 'General case' 0 C--O 1.212 -0.902 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.319 -176.701 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.554 HD23 HG23 ' A' ' 27' ' ' ILE . 8.9 tp -87.57 -36.27 17.64 Favored 'General case' 0 C--N 1.315 -0.91 0 O-C-N 123.569 0.543 . . . . 0.0 111.153 -167.049 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.48 -49.35 79.55 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.297 177.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 68.8 p -83.41 -10.08 58.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.048 0.451 . . . . 0.0 111.64 -177.11 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.815 ' HB2' ' O ' ' A' ' 30' ' ' GLU . 53.2 ttm-85 -83.31 -45.16 14.1 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.051 -177.748 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.444 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 8.0 t70 -138.09 128.23 15.24 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.583 -176.36 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 20.6 Cg_exo -66.87 -13.06 38.48 Favored 'Trans proline' 0 N--CA 1.465 -0.168 0 C-N-CA 123.517 2.811 . . . . 0.0 113.269 -178.058 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.523 ' HA ' ' HB2' ' A' ' 40' ' ' MET . 79.7 mtm180 -64.54 -19.45 65.63 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -70.3 -24.44 63.02 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 121.082 0.467 . . . . 0.0 109.881 175.196 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 53.9 m95 -101.6 -18.86 15.71 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.768 -178.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.523 ' HB2' ' HA ' ' A' ' 37' ' ' ARG . 18.3 ttp -52.55 -46.51 66.82 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 121.407 0.622 . . . . 0.0 109.778 175.117 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.429 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 7.6 p -89.19 133.97 29.83 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 168.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.4 143.01 50.95 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-O 121.334 0.588 . . . . 0.0 109.829 177.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -82.53 97.52 8.48 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.892 -165.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -103.26 101.41 22.29 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 114.691 -1.14 . . . . 0.0 108.45 170.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -59.23 -25.56 78.62 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.872 2.382 . . . . 0.0 112.574 -176.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.411 ' HA ' HD22 ' A' ' 46' ' ' LEU . 0.7 OUTLIER -75.47 -39.3 58.87 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 -179.795 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 47.1 t90 -75.52 -38.38 59.44 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.567 176.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.583 ' HE2' ' HE2' ' A' ' 9' ' ' PHE . 2.8 mptm? -62.66 -33.23 74.62 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 176.309 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.406 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 24.9 mttm -75.73 -41.43 53.39 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 120.975 -0.29 . . . . 0.0 110.833 176.242 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -61.55 -48.15 82.32 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.226 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 3.5 ppp? -75.28 -27.69 59.49 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.787 -174.31 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.617 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 35.3 t80 -74.59 -38.97 62.47 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.678 178.867 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 49' ' ' LYS . 45.2 mt-10 -73.0 -23.05 60.59 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 176.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.442 ' HE3' ' ND2' ' A' ' 58' ' ' ASN . 31.8 tptt -73.22 -38.45 66.06 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.522 0.677 . . . . 0.0 109.456 172.307 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.713 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 61.7 t80 -71.75 -23.06 61.54 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.666 -177.652 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.617 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 56.3 mt -89.5 -33.8 16.64 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.961 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -95.72 -53.32 3.75 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.887 0.375 . . . . 0.0 110.805 -176.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.442 ' ND2' ' HE3' ' A' ' 54' ' ' LYS . 61.8 t30 -75.11 -53.38 8.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.018 178.765 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.713 ' HG2' ' O ' ' A' ' 55' ' ' TYR . 77.1 mtt180 . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.438 -178.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.491 0 N-CA-C 111.603 -0.599 . . . . 0.0 111.603 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.753 ' HB1' ' HB3' ' A' ' 5' ' ' ALA . . . -101.45 97.16 7.66 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.754 0.311 . . . . 0.0 110.519 -177.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 83.1 mtp -92.61 -63.38 1.23 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.025 0.44 . . . . 0.0 109.952 179.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.582 ' O ' ' HG3' ' A' ' 8' ' ' GLU . 23.1 mt-10 -64.1 -40.59 96.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.941 176.724 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.753 ' HB3' ' HB1' ' A' ' 2' ' ' ALA . . . -63.22 -35.69 81.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.685 -178.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.54 ' O ' HG12 ' A' ' 10' ' ' ILE . 32.6 tt0 -58.8 -51.26 70.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.352 0.596 . . . . 0.0 109.849 174.271 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.432 ' HE2' ' HB3' ' A' ' 7' ' ' LYS . 51.1 mtpt -63.03 -39.33 94.44 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.012 -179.099 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.582 ' HG3' ' O ' ' A' ' 4' ' ' GLU . 42.5 mt-10 -63.36 -40.23 96.69 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 120.904 0.383 . . . . 0.0 110.066 176.076 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.45 ' HA ' ' HG2' ' A' ' 12' ' ' MET . 48.2 t80 -60.75 -37.83 83.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.104 176.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.628 ' O ' ' HD2' ' A' ' 14' ' ' LYS . 41.0 mm -71.81 -37.08 60.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.387 178.194 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.6 m -66.67 -40.55 88.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.486 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.528 ' SD ' ' HB3' ' A' ' 37' ' ' ARG . 24.3 ptm -73.41 -22.24 60.28 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.512 HD23 ' HG3' ' A' ' 12' ' ' MET . 0.1 OUTLIER -70.45 -37.83 74.39 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.335 176.563 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.628 ' HD2' ' O ' ' A' ' 10' ' ' ILE . 3.8 mptt -68.16 -37.71 81.3 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.321 0.582 . . . . 0.0 109.847 173.65 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -66.21 -36.78 83.94 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.95 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -88.95 10.12 22.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.056 -179.159 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 61.71 31.79 18.48 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.37 176.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.479 HG11 HD13 ' A' ' 13' ' ' LEU . 40.2 t -75.75 139.47 18.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.682 0.277 . . . . 0.0 110.871 -177.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.469 ' OD1' HG22 ' A' ' 21' ' ' THR . 4.5 p-10 -156.4 -161.02 1.05 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.023 175.68 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.686 ' HA ' HD22 ' A' ' 56' ' ' LEU . 69.3 m -60.39 -30.52 69.64 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -175.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.469 HG22 ' OD1' ' A' ' 19' ' ' ASP . 13.2 t -81.19 11.31 4.34 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.991 0.424 . . . . 0.0 111.935 -175.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.449 ' CH2' HD11 ' A' ' 31' ' ' LEU . 5.3 m95 -96.67 138.87 33.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.201 0.525 . . . . 0.0 111.56 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -97.03 154.85 17.07 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 171.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.467 ' HD1' HD12 ' A' ' 27' ' ' ILE . 67.2 t80 -86.19 14.96 5.62 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 122.196 0.998 . . . . 0.0 110.358 -175.303 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.0 m -93.31 -33.31 13.96 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 114.315 -1.311 . . . . 0.0 107.581 168.317 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -70.13 -36.91 75.12 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 114.05 -1.432 . . . . 0.0 109.512 176.646 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.725 HG23 HD22 ' A' ' 31' ' ' LEU . 28.4 mt -61.1 -54.95 28.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.244 173.5 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 68.4 mt -61.55 -37.1 77.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 120.022 -0.671 . . . . 0.0 111.459 179.249 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.8 t -79.29 -40.94 29.21 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -173.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -99.86 -34.14 10.26 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.851 -175.361 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.725 HD22 HG23 ' A' ' 27' ' ' ILE . 4.2 mp -84.47 -23.51 29.86 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 -176.07 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -76.45 -13.34 83.51 Favored Glycine 0 N--CA 1.444 -0.814 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.588 174.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.4 p -114.58 -45.94 2.98 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 -176.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 90.1 mtt-85 -56.38 -44.69 80.46 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -177.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.444 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 9.7 t70 -145.91 130.64 8.93 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-O 120.829 0.347 . . . . 0.0 111.067 -173.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 24.5 Cg_exo -64.66 -4.99 9.39 Favored 'Trans proline' 0 CA--C 1.531 0.375 0 C-N-CA 123.6 2.866 . . . . 0.0 113.744 -178.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.528 ' HB3' ' SD ' ' A' ' 12' ' ' MET . 13.3 mtm180 -55.28 -28.64 54.82 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 176.074 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 70.9 t80 -68.64 -20.21 64.46 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.001 0.429 . . . . 0.0 110.133 178.47 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 58.7 m95 -107.05 -21.95 12.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.241 -177.275 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 85.0 mtp -58.17 -42.48 86.13 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.442 0.639 . . . . 0.0 109.341 174.289 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.679 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 6.7 p -86.21 132.01 33.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.328 -0.851 . . . . 0.0 108.842 169.403 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.19 143.58 48.54 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-O 121.482 0.658 . . . . 0.0 110.282 179.176 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -94.03 97.71 10.51 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.385 -166.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -105.88 97.83 16.39 Favored Pre-proline 0 N--CA 1.442 -0.862 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 163.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.62 ' HA ' ' HB2' ' A' ' 48' ' ' LYS . 24.2 Cg_exo -63.1 -22.37 73.18 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.65 2.234 . . . . 0.0 112.474 -171.653 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -74.78 -39.27 61.84 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 177.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' TRP . . . . . 0.404 ' O ' ' HG2' ' A' ' 51' ' ' MET . 45.3 t90 -72.93 -38.36 66.86 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 173.378 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.62 ' HB2' ' HA ' ' A' ' 45' ' ' PRO . 24.8 mmtp -59.78 -33.66 71.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.185 177.548 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.599 ' HB3' ' O ' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -87.07 -32.82 19.75 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.509 -178.657 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -67.14 -39.55 86.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.048 0.451 . . . . 0.0 111.131 176.313 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.499 ' HE3' ' HG3' ' A' ' 6' ' ' GLU . 16.9 ptm -74.79 -26.39 59.71 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.719 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.665 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 32.4 t80 -69.37 -36.06 76.45 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.209 173.007 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.511 ' HG2' ' O ' ' A' ' 49' ' ' LYS . 38.0 mm-40 -65.13 -31.95 73.4 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.248 0.547 . . . . 0.0 109.651 175.807 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -72.99 -38.6 66.59 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.99 177.03 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.426 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 86.1 t80 -70.02 -20.99 63.24 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.084 -177.556 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.686 HD22 ' HA ' ' A' ' 20' ' ' SER . 87.1 mt -81.75 -33.24 31.12 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.258 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 37.0 p -100.32 -46.45 5.26 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.9 0.381 . . . . 0.0 111.632 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.416 ' O ' ' HB2' ' A' ' 59' ' ' ARG . 6.8 t30 -89.59 -47.65 7.82 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.705 -176.347 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.426 ' HG2' ' O ' ' A' ' 55' ' ' TYR . 76.3 mtt180 . . . . . 0 C--O 1.251 1.151 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.231 -173.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.9 0 N-CA-C 111.868 -0.493 . . . . 0.0 111.868 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -108.56 61.31 0.6 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.925 0.393 . . . . 0.0 111.641 -176.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 78.5 mtp -106.65 -97.91 0.35 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 173.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -63.03 -30.82 71.9 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.305 0.574 . . . . 0.0 110.041 177.242 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.605 ' O ' ' HB2' ' A' ' 9' ' ' PHE . . . -56.18 -56.45 20.72 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.691 177.368 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.44 ' O ' HG12 ' A' ' 10' ' ' ILE . 28.9 tt0 -71.06 -47.12 60.22 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.972 -178.251 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.631 ' HE2' ' O ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -42.3 -64.1 0.65 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.772 -1.104 . . . . 0.0 111.305 176.45 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.539 ' HB3' ' HD2' ' A' ' 37' ' ' ARG . 56.0 mm-40 -78.41 -16.71 57.32 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.75 -0.38 . . . . 0.0 112.009 -175.054 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.605 ' HB2' ' O ' ' A' ' 5' ' ' ALA . 21.3 t80 -69.5 -40.04 77.25 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 175.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 6' ' ' GLU . 46.0 mm -74.41 -36.31 41.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 121.551 0.691 . . . . 0.0 109.824 178.011 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 19.9 m -66.92 -33.29 75.27 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.607 178.275 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 18.1 ttp -76.57 -32.4 58.12 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.107 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.473 HD13 HG11 ' A' ' 18' ' ' VAL . 0.1 OUTLIER -68.43 -38.57 81.3 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.104 179.105 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 14.3 mtpt -68.18 -40.96 82.1 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.012 0.434 . . . . 0.0 110.845 175.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.437 ' CD ' HH22 ' A' ' 37' ' ' ARG . 29.8 mt-10 -67.05 -18.56 65.4 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.078 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -105.05 16.56 25.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.785 178.186 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 56.28 32.42 20.36 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.527 -0.761 . . . . 0.0 112.682 176.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.473 HG11 HD13 ' A' ' 13' ' ' LEU . 58.1 t -76.41 119.41 24.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.008 0.433 . . . . 0.0 111.288 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -128.58 -156.0 0.73 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.507 172.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.1 p -68.91 -8.72 46.81 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.034 0.445 . . . . 0.0 111.365 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.4 p -79.77 9.66 4.94 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.781 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.682 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 11.7 m95 -117.76 146.2 43.96 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.15 0.5 . . . . 0.0 111.876 -175.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.9 m -110.17 164.93 12.16 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 165.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.682 ' CE1' ' HB3' ' A' ' 48' ' ' LYS . 88.5 t80 -82.99 16.27 2.39 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 122.308 1.051 . . . . 0.0 110.891 -171.546 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.5 m -92.16 -32.55 15.06 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 113.861 -1.518 . . . . 0.0 107.947 171.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.682 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 42.5 ttt180 -71.07 -35.46 71.9 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.408 -1.269 . . . . 0.0 109.398 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.555 HG12 HD22 ' A' ' 31' ' ' LEU . 54.9 mt -64.62 -54.45 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.867 175.131 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.1 mt -62.23 -40.19 86.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 C-N-CA 119.691 -0.804 . . . . 0.0 111.348 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.6 t -76.96 -39.27 51.22 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -173.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -112.65 -33.28 6.18 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -173.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.555 HD22 HG12 ' A' ' 27' ' ' ILE . 1.6 mp -78.28 -30.27 48.41 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 122.04 -0.413 . . . . 0.0 110.859 -177.089 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.66 -18.61 64.04 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.731 -0.747 . . . . 0.0 111.969 175.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.0 p -112.06 -27.69 8.29 Favored 'General case' 0 C--O 1.234 0.254 0 O-C-N 122.381 -0.481 . . . . 0.0 111.996 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.9 mtm180 -74.67 -30.48 61.6 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -178.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.467 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 7.9 t70 -151.48 128.97 5.67 Favored Pre-proline 0 C--N 1.329 -0.3 0 C-N-CA 120.199 -0.6 . . . . 0.0 111.185 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 16.3 Cg_exo -69.85 -5.34 16.02 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 123.466 2.777 . . . . 0.0 113.825 -178.208 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.539 ' HD2' ' HB3' ' A' ' 8' ' ' GLU . 57.7 mtm180 -60.62 -22.28 63.61 Favored 'General case' 0 C--N 1.333 -0.123 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 176.25 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 69.1 t80 -68.3 -20.62 64.77 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.899 0.381 . . . . 0.0 110.007 176.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 56.7 m95 -105.25 -17.88 14.31 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.4 -176.358 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 90.5 mmm -57.65 -37.77 73.94 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.324 0.583 . . . . 0.0 109.87 175.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 6.3 p -96.62 141.3 15.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.455 -0.793 . . . . 0.0 108.886 169.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -59.92 143.7 50.85 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-O 121.616 0.722 . . . . 0.0 109.735 175.166 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -81.56 97.25 7.75 Favored 'General case' 0 C--N 1.301 -1.509 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.089 -171.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -102.05 98.25 9.81 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 170.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -61.41 -30.57 87.31 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.66 2.24 . . . . 0.0 112.699 -173.65 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.475 ' HA ' HD22 ' A' ' 46' ' ' LEU . 0.6 OUTLIER -72.53 -40.0 67.1 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.742 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 47' ' ' TRP . . . . . 0.484 ' O ' ' HG2' ' A' ' 51' ' ' MET . 41.8 t90 -73.79 -38.04 64.76 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-N 116.778 -0.192 . . . . 0.0 110.567 176.792 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.682 ' HB3' ' CE1' ' A' ' 24' ' ' PHE . 2.5 mptm? -63.37 -33.37 75.38 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.289 177.283 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.415 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 23.7 mttm -73.76 -40.6 63.37 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 120.927 0.394 . . . . 0.0 110.19 176.018 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 42.8 mt-10 -63.23 -44.64 94.68 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.067 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.484 ' HG2' ' O ' ' A' ' 47' ' ' TRP . 13.5 ptm -76.7 -21.61 55.08 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.215 -176.634 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.409 ' CZ ' HD11 ' A' ' 56' ' ' LEU . 22.5 t80 -76.35 -37.95 56.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.167 176.294 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 49' ' ' LYS . 37.7 mt-10 -67.56 -30.95 70.72 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 175.402 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.4 tttt -71.85 -37.69 70.2 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.392 175.358 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -66.85 -23.72 66.06 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.941 0.4 . . . . 0.0 111.039 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.409 HD11 ' CZ ' ' A' ' 52' ' ' PHE . 67.4 mt -98.6 -33.46 10.96 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.6 t -89.48 -23.32 22.12 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.05 0.453 . . . . 0.0 111.233 -177.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -126.41 -53.06 1.48 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.665 -178.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 . . . . . 0 C--O 1.251 1.164 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.585 -179.688 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.69 0 N-CA-C 111.957 -0.457 . . . . 0.0 111.957 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 61.94 35.28 16.33 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-O 121.159 0.504 . . . . 0.0 110.507 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 12.6 tpt -95.65 -45.76 6.9 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.978 -177.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -65.11 -47.7 76.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.726 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.572 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -59.28 -43.36 92.55 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.58 -1.191 . . . . 0.0 111.265 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.721 ' HG3' ' HE3' ' A' ' 51' ' ' MET . 32.1 tt0 -63.78 -49.55 72.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.014 0.435 . . . . 0.0 110.641 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.46 ' HE2' ' HB3' ' A' ' 7' ' ' LYS . 15.1 ttpt -49.73 -51.45 38.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.362 -0.836 . . . . 0.0 112.122 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -71.32 -33.55 69.75 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.044 -179.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.637 ' O ' HD23 ' A' ' 13' ' ' LEU . 36.2 t80 -61.68 -38.17 86.83 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.133 0.492 . . . . 0.0 110.113 177.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.515 HG12 ' O ' ' A' ' 6' ' ' GLU . 44.4 mm -71.97 -35.91 55.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.349 0.595 . . . . 0.0 110.145 177.653 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 48.4 m -67.94 -41.5 82.45 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.642 -179.059 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.555 ' SD ' ' HA ' ' A' ' 9' ' ' PHE . 21.7 ptm -70.44 -28.99 65.46 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -179.574 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.637 HD23 ' O ' ' A' ' 9' ' ' PHE . 1.8 mm? -68.46 -37.4 80.15 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.022 177.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.412 ' HE3' ' HE1' ' A' ' 55' ' ' TYR . 12.6 mttt -69.73 -38.51 76.91 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.925 175.367 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -68.28 -27.5 66.38 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.768 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.583 ' ND2' ' HG ' ' A' ' 31' ' ' LEU . 94.3 m-20 -90.82 9.5 29.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.216 -179.151 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 57.48 31.35 20.11 Favored 'General case' 0 CA--C 1.526 0.046 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.267 176.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.605 HG21 HD13 ' A' ' 13' ' ' LEU . 66.3 t -74.1 129.45 36.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.605 -175.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -120.57 -162.58 0.95 Allowed 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 170.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.6 p -77.24 -6.45 53.11 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.899 0.38 . . . . 0.0 111.693 -178.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.5 p -81.8 -13.48 57.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.904 0.383 . . . . 0.0 111.459 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.517 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 6.1 m95 -74.2 136.02 42.78 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.704 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.8 t -90.25 156.66 18.14 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 169.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.538 ' CZ ' ' HB3' ' A' ' 48' ' ' LYS . 42.1 t80 -83.49 16.68 2.48 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 122.123 0.963 . . . . 0.0 109.513 -177.183 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 27.4 t -93.1 -41.7 9.8 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.135 -1.393 . . . . 0.0 107.611 171.288 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.517 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 54.2 ttt180 -65.25 -34.29 78.02 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.092 -1.413 . . . . 0.0 109.506 176.599 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.749 HG23 HD22 ' A' ' 31' ' ' LEU . 59.6 mt -62.99 -56.76 15.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.153 174.575 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.473 HG12 ' O ' ' A' ' 24' ' ' PHE . 40.1 mm -59.59 -38.46 75.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 120.583 -0.447 . . . . 0.0 111.644 179.125 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.8 t -82.16 -38.81 24.13 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -171.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.531 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 8.3 mm-40 -100.55 -35.26 9.58 Favored 'General case' 0 C--O 1.217 -0.657 0 C-N-CA 120.462 -0.495 . . . . 0.0 111.429 -176.103 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.749 HD22 HG23 ' A' ' 27' ' ' ILE . 4.6 mp -82.19 -20.14 38.42 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -177.55 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -79.42 -6.79 88.85 Favored Glycine 0 N--CA 1.44 -1.056 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.571 173.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 38.8 p -125.84 -29.16 3.14 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -176.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 41.5 mtt180 -56.85 -52.14 66.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.635 0.255 . . . . 0.0 111.085 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.456 ' OD1' ' HB2' ' A' ' 37' ' ' ARG . 1.8 p30 -154.93 148.96 19.04 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.297 178.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.437 ' O ' ' HG2' ' A' ' 40' ' ' MET . 20.5 Cg_exo -66.74 4.5 1.06 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.682 2.922 . . . . 0.0 114.295 -174.749 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.456 ' HB2' ' OD1' ' A' ' 35' ' ' ASP . 54.3 mtm180 -59.21 -34.92 72.73 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 117.77 0.259 . . . . 0.0 111.599 178.541 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -69.2 -17.26 63.77 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 120.899 0.38 . . . . 0.0 110.173 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -102.2 -19.25 15.16 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.725 -179.166 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.437 ' HG2' ' O ' ' A' ' 36' ' ' PRO . 95.7 mmm -64.11 -51.88 61.86 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 172.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.572 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 2.6 p -86.58 114.16 25.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.144 -0.934 . . . . 0.0 109.066 171.678 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -58.4 145.6 37.8 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 122.184 0.993 . . . . 0.0 111.709 -172.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -78.67 96.9 5.65 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 114.081 -1.418 . . . . 0.0 112.071 -170.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -104.14 99.59 17.64 Favored Pre-proline 0 C--N 1.32 -0.704 0 N-CA-C 107.551 -1.278 . . . . 0.0 107.551 165.206 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -62.47 -24.73 75.59 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 122.354 2.036 . . . . 0.0 113.098 -172.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.44 HD22 ' HA ' ' A' ' 46' ' ' LEU . 0.6 OUTLIER -80.62 -39.53 27.3 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 -179.19 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 47' ' ' TRP . . . . . 0.492 ' O ' ' HG2' ' A' ' 51' ' ' MET . 44.4 t90 -74.76 -37.83 62.37 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.403 175.665 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.634 ' HG3' ' CZ ' ' A' ' 9' ' ' PHE . 1.2 mptm? -61.99 -32.27 72.72 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.256 -0.275 . . . . 0.0 110.256 177.637 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 36.3 mttt -77.62 -39.4 45.51 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 120.841 0.353 . . . . 0.0 110.711 175.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -64.11 -40.08 95.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.037 0.446 . . . . 0.0 111.266 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.721 ' HE3' ' HG3' ' A' ' 6' ' ' GLU . 12.7 ptm -79.13 -21.33 46.7 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.558 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 22.3 t80 -69.9 -37.15 75.91 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.514 -0.551 . . . . 0.0 109.514 173.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -67.01 -30.91 71.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.133 173.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.464 ' HE2' ' OD1' ' A' ' 58' ' ' ASN . 13.7 tptm -71.72 -38.32 70.51 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.253 176.018 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.45 ' O ' ' HA ' ' A' ' 59' ' ' ARG . 32.4 t80 -65.79 -34.13 77.45 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.602 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 76.0 mt -79.24 -32.04 43.73 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 120.943 -0.303 . . . . 0.0 111.511 -179.25 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.1 p -87.08 -64.0 1.22 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.888 0.375 . . . . 0.0 111.692 178.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.517 ' O ' ' HB2' ' A' ' 59' ' ' ARG . 0.2 OUTLIER -70.45 -47.92 58.36 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.275 -178.214 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.517 ' HB2' ' O ' ' A' ' 58' ' ' ASN . 21.6 mmt180 . . . . . 0 C--O 1.246 0.887 0 O-C-N 123.988 0.805 . . . . 0.0 110.723 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.794 0 N-CA-C 111.996 -0.442 . . . . 0.0 111.996 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.406 ' O ' ' HB2' ' A' ' 6' ' ' GLU . . . -79.92 8.31 7.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.928 0.394 . . . . 0.0 111.459 -179.58 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 38.4 ttp -87.32 -54.07 4.49 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.308 0.575 . . . . 0.0 109.515 177.209 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -62.18 -46.1 90.46 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.087 177.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.585 ' CB ' ' HB ' ' A' ' 41' ' ' VAL . . . -63.97 -29.68 70.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.979 -1.009 . . . . 0.0 111.315 -179.434 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.503 ' O ' HG12 ' A' ' 10' ' ' ILE . 12.9 tt0 -60.81 -56.62 19.09 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.417 0.627 . . . . 0.0 110.3 177.209 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.493 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -58.32 -42.57 87.05 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.806 -1.088 . . . . 0.0 111.374 -178.545 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -62.14 -38.59 89.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.203 0.525 . . . . 0.0 110.478 176.062 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.543 ' CZ ' ' HG3' ' A' ' 48' ' ' LYS . 14.6 t80 -64.84 -39.58 93.8 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.084 178.502 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.503 HG12 ' O ' ' A' ' 6' ' ' GLU . 48.1 mm -70.75 -37.77 70.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.138 0.494 . . . . 0.0 110.542 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 35.1 m -68.65 -31.71 71.04 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.332 176.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.486 ' SD ' ' HB3' ' A' ' 35' ' ' ASP . 37.8 ttp -71.78 -33.29 68.47 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 177.824 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.673 HD22 HD21 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -71.02 -39.84 72.13 Favored 'General case' 0 N--CA 1.439 -0.977 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.935 178.903 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.0 mtpp -64.67 -35.42 80.98 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.178 0.513 . . . . 0.0 110.611 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.502 ' CD ' HH22 ' A' ' 37' ' ' ARG . 29.7 mt-10 -70.63 -22.84 62.48 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.018 178.466 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -101.98 7.19 41.43 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.415 176.75 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 47.6 mm-40 56.76 31.11 18.86 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 173.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.597 HG11 HD13 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -67.32 143.89 15.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.658 0.742 . . . . 0.0 111.274 -179.969 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.502 ' CG ' ' N ' ' A' ' 20' ' ' SER . 0.0 OUTLIER -148.25 -174.22 4.52 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.848 179.012 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.502 ' N ' ' CG ' ' A' ' 19' ' ' ASP . 4.3 p -58.02 -23.15 53.01 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 120.857 0.36 . . . . 0.0 111.754 -175.384 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.2 p -77.45 -1.4 30.11 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.707 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 4.3 m95 -84.94 144.96 28.0 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.927 0.394 . . . . 0.0 110.398 174.435 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.8 p -102.88 165.78 10.84 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 172.325 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.501 ' CD1' HD12 ' A' ' 27' ' ' ILE . 30.2 t80 -87.21 15.87 5.8 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 122.48 1.133 . . . . 0.0 108.553 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.2 t -91.43 -38.78 12.36 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 106.633 -1.618 . . . . 0.0 106.633 168.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.707 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 36.9 ttt180 -67.44 -34.5 77.33 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.595 176.489 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.737 HG23 HD23 ' A' ' 31' ' ' LEU . 52.0 mt -66.61 -42.08 89.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.644 178.675 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.1 mt -78.64 -33.34 16.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 C-N-CA 119.284 -0.966 . . . . 0.0 111.866 176.472 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.7 p -87.64 -40.58 14.06 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -171.473 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.633 ' O ' ' HD3' ' A' ' 34' ' ' ARG . 26.2 mm-40 -106.82 -36.56 6.63 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 121.279 0.561 . . . . 0.0 110.219 -176.152 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.737 HD23 HG23 ' A' ' 27' ' ' ILE . 11.5 tp -80.22 -36.17 35.19 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.322 -170.241 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.56 -22.34 76.55 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.087 175.439 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 35.5 p -101.57 -28.29 12.61 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 122.425 -0.456 . . . . 0.0 111.731 -178.456 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.633 ' HD3' ' O ' ' A' ' 30' ' ' GLU . 0.5 OUTLIER -63.34 -48.57 77.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.319 179.175 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.496 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 4.8 t70 -139.04 133.92 16.58 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-O 121.056 0.455 . . . . 0.0 111.722 -170.186 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.496 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 17.1 Cg_exo -68.4 -11.81 33.05 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 123.694 2.93 . . . . 0.0 113.158 -179.078 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.506 ' HA ' ' HG2' ' A' ' 40' ' ' MET . 72.2 mtm180 -62.16 -20.95 64.65 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 177.865 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -68.32 -21.71 64.74 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.967 0.413 . . . . 0.0 110.165 176.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.443 ' HD1' ' HA ' ' A' ' 36' ' ' PRO . 60.6 m95 -101.86 -17.74 16.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.683 -174.889 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.506 ' HG2' ' HA ' ' A' ' 37' ' ' ARG . 96.7 mmm -55.49 -37.16 67.46 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.234 0.54 . . . . 0.0 110.371 178.815 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.585 ' HB ' ' CB ' ' A' ' 5' ' ' ALA . 6.8 p -99.01 134.4 38.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 171.031 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -59.75 142.34 53.43 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-O 121.486 0.66 . . . . 0.0 109.875 177.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -78.8 98.83 6.45 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.008 -0.997 . . . . 0.0 112.547 -163.161 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -103.65 101.12 22.18 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 114.817 -1.083 . . . . 0.0 108.449 169.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -63.0 -26.61 73.94 Favored 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.855 2.37 . . . . 0.0 112.53 -175.056 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.543 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 1.1 tm? -75.75 -39.05 57.8 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' TRP . . . . . 0.482 ' O ' ' HG2' ' A' ' 51' ' ' MET . 45.4 t90 -74.53 -37.06 63.16 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.691 176.246 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.543 ' HG3' ' CZ ' ' A' ' 9' ' ' PHE . 2.3 mptm? -62.07 -32.46 73.0 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.593 -0.443 . . . . 0.0 109.978 175.452 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.559 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 26.9 mttm -72.69 -40.86 65.9 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 120.916 0.388 . . . . 0.0 110.31 174.633 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.543 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 26.5 mt-10 -66.15 -41.88 89.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.309 -178.303 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.482 ' HG2' ' O ' ' A' ' 47' ' ' TRP . 12.5 ptm -76.35 -22.05 55.36 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.86 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.503 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 28.2 t80 -75.26 -37.61 60.87 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.134 -0.484 . . . . 0.0 109.721 175.08 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.559 ' HG2' ' O ' ' A' ' 49' ' ' LYS . 79.0 mm-40 -66.35 -29.1 69.21 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 121.199 0.524 . . . . 0.0 109.634 174.02 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -72.53 -38.43 68.02 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.979 174.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.592 ' CE2' HG13 ' A' ' 18' ' ' VAL . 53.6 t80 -70.72 -23.08 62.38 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.621 -178.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 60.7 mt -93.54 -33.25 13.82 Favored 'General case' 0 N--CA 1.441 -0.896 0 C-N-CA 120.646 -0.422 . . . . 0.0 111.795 179.348 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 45.4 t -87.63 -32.44 19.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.8 0.333 . . . . 0.0 111.103 -178.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -109.45 -58.61 2.02 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.326 -0.397 . . . . 0.0 109.997 -178.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.8 ttm180 . . . . . 0 C--O 1.251 1.171 0 O-C-N 124.254 0.971 . . . . 0.0 110.256 -178.333 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.898 0 N-CA-C 112.037 -0.425 . . . . 0.0 112.037 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -83.19 18.14 1.82 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.95 0.405 . . . . 0.0 111.731 -176.098 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 69.3 mtm -105.53 -66.94 0.95 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.23 0.538 . . . . 0.0 109.737 176.156 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -65.26 -50.85 64.21 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.952 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 9' ' ' PHE . . . -61.67 -29.76 70.29 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.935 -178.751 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -63.14 -54.12 42.7 Favored 'General case' 0 CA--C 1.509 -0.596 0 CA-C-O 121.354 0.597 . . . . 0.0 110.0 177.095 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.402 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -54.87 -45.64 74.64 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.668 -1.151 . . . . 0.0 111.815 -179.263 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.54 ' O ' ' HG2' ' A' ' 12' ' ' MET . 53.2 mm-40 -68.13 -35.41 78.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.586 0.232 . . . . 0.0 111.228 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.578 ' CZ ' ' HG3' ' A' ' 48' ' ' LYS . 12.6 t80 -64.22 -38.46 91.11 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.759 177.316 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.536 HD11 ' HE3' ' A' ' 54' ' ' LYS . 24.4 mm -65.53 -37.44 80.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.572 0.701 . . . . 0.0 109.82 173.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.659 ' HA ' ' CE ' ' A' ' 14' ' ' LYS . 32.7 m -69.17 -41.39 77.29 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.546 -178.138 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.54 ' HG2' ' O ' ' A' ' 8' ' ' GLU . 15.8 ptm -73.2 -33.52 65.43 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 -179.548 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.518 HD13 HG21 ' A' ' 18' ' ' VAL . 1.7 mm? -68.51 -38.03 80.57 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.578 179.23 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.659 ' CE ' ' HA ' ' A' ' 11' ' ' THR . 0.0 OUTLIER -83.38 -24.18 32.11 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.817 -178.052 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -72.71 -34.57 67.21 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 120.996 0.426 . . . . 0.0 110.87 172.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.479 ' OD1' ' HG ' ' A' ' 31' ' ' LEU . 1.0 OUTLIER -79.3 10.16 3.96 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.987 179.953 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 55.06 31.67 16.67 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.225 177.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.518 HG21 HD13 ' A' ' 13' ' ' LEU . 53.2 t -75.17 150.14 6.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.602 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.421 ' CG ' ' H ' ' A' ' 20' ' ' SER . 6.9 t70 -168.71 -154.7 0.14 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 171.81 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.421 ' H ' ' CG ' ' A' ' 19' ' ' ASP . 12.3 m -59.69 -27.15 66.17 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -171.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.4 p -83.91 34.77 0.5 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.439 0.638 . . . . 0.0 111.687 -177.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.656 ' CE3' ' HB3' ' A' ' 26' ' ' ARG . 8.9 m95 -133.88 148.35 51.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.044 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 21.7 m -114.01 169.99 8.61 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 169.613 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.514 ' CZ ' ' HB3' ' A' ' 48' ' ' LYS . 42.6 t80 -83.89 16.75 2.65 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 122.03 0.919 . . . . 0.0 110.875 -170.602 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.4 m -93.29 -43.93 8.56 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.096 -1.411 . . . . 0.0 107.995 172.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.656 ' HB3' ' CE3' ' A' ' 22' ' ' TRP . 11.8 ttt180 -59.4 -36.35 75.66 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.52 176.295 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.666 HG23 HD22 ' A' ' 31' ' ' LEU . 65.7 mt -64.48 -58.78 5.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.73 177.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.2 mt -62.92 -41.31 92.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 119.898 -0.721 . . . . 0.0 111.641 -178.049 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.2 m -78.0 -36.91 48.29 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -175.072 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.57 ' HB2' ' O ' ' A' ' 26' ' ' ARG . 48.1 mm-40 -98.17 -36.82 9.93 Favored 'General case' 0 C--O 1.221 -0.436 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -178.234 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.666 HD22 HG23 ' A' ' 27' ' ' ILE . 5.3 mp -83.96 -28.44 27.78 Favored 'General case' 0 CA--C 1.508 -0.637 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.372 -171.336 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.19 -20.24 66.99 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.563 -0.827 . . . . 0.0 111.472 175.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.7 p -108.46 -33.79 6.96 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 178.379 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.48 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 39.9 mtt180 -58.89 -51.29 70.67 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 120.596 0.236 . . . . 0.0 111.141 178.16 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.474 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 6.2 t70 -139.55 129.38 14.13 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-O 121.042 0.449 . . . . 0.0 111.042 -172.856 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.474 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 17.1 Cg_exo -68.76 -8.29 22.95 Favored 'Trans proline' 0 CA--C 1.528 0.183 0 C-N-CA 123.539 2.826 . . . . 0.0 113.036 -178.525 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.63 ' HA ' ' HG3' ' A' ' 40' ' ' MET . 66.1 mtm180 -62.59 -21.57 65.72 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 178.504 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -66.53 -20.08 65.94 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 177.176 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.42 ' HD1' ' HA ' ' A' ' 36' ' ' PRO . 60.5 m95 -97.89 -18.05 18.92 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.443 -0.799 . . . . 0.0 112.082 -174.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.63 ' HG3' ' HA ' ' A' ' 37' ' ' ARG . 42.8 mtm -55.63 -49.24 73.37 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.614 0.721 . . . . 0.0 109.605 177.312 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.402 HG21 ' CZ3' ' A' ' 47' ' ' TRP . 4.2 p -99.28 122.67 51.33 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 CA-C-N 114.964 -1.017 . . . . 0.0 108.984 172.504 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -58.36 146.44 34.64 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-O 121.81 0.814 . . . . 0.0 111.166 -174.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.408 ' HA ' ' NZ ' ' A' ' 48' ' ' LYS . 15.1 p-10 -68.87 95.43 0.69 Allowed 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 114.349 -1.296 . . . . 0.0 112.104 -168.695 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -102.31 100.44 15.59 Favored Pre-proline 0 N--CA 1.444 -0.738 0 CA-C-N 114.367 -1.288 . . . . 0.0 107.752 169.057 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -60.81 -29.69 88.71 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 122.209 1.939 . . . . 0.0 112.325 -173.516 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 2.6 tm? -73.37 -39.94 64.75 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -178.865 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' TRP . . . . . 0.402 ' CZ3' HG21 ' A' ' 41' ' ' VAL . 42.3 t90 -77.77 -37.56 48.73 Favored 'General case' 0 C--O 1.222 -0.343 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.611 177.222 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.578 ' HG3' ' CZ ' ' A' ' 9' ' ' PHE . 1.4 mptm? -62.38 -31.73 72.44 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 177.26 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.4 mttt -77.92 -40.12 40.67 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.69 0.281 . . . . 0.0 111.019 175.444 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.468 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 27.0 mt-10 -61.86 -46.1 90.9 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.441 0.639 . . . . 0.0 110.664 179.17 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.478 ' SD ' ' CD1' ' A' ' 9' ' ' PHE . 0.7 OUTLIER -71.85 -33.37 68.38 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.712 -177.927 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.458 ' CZ ' HD11 ' A' ' 56' ' ' LEU . 26.1 t80 -70.44 -38.3 74.49 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.513 -178.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 50' ' ' GLU . 11.6 pt-20 -72.28 -22.93 61.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.4 0.619 . . . . 0.0 109.818 178.233 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.697 ' HG2' ' HB2' ' A' ' 58' ' ' ASN . 2.7 tmmm? -72.5 -37.15 68.49 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.278 171.051 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.633 ' OH ' ' HA ' ' A' ' 14' ' ' LYS . 54.9 t80 -66.44 -21.95 66.21 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.961 0.41 . . . . 0.0 110.318 176.294 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.458 HD11 ' CZ ' ' A' ' 52' ' ' PHE . 60.8 mt -95.37 -35.33 11.8 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 178.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 44.0 t -88.57 -55.43 3.72 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.12 0.486 . . . . 0.0 110.579 -178.48 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.697 ' HB2' ' HG2' ' A' ' 54' ' ' LYS . 5.6 m120 -77.02 -51.62 10.77 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.348 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.429 HH11 ' HD2' ' A' ' 59' ' ' ARG . 48.7 mtt180 . . . . . 0 C--O 1.248 0.992 0 O-C-N 123.936 0.773 . . . . 0.0 110.629 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.411 ' HB2' ' OE1' ' A' ' 4' ' ' GLU . 69.5 mtm . . . . . 0 C--O 1.234 0.26 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.411 ' OE1' ' HB2' ' A' ' 3' ' ' MET . 1.8 mp0 -61.25 -46.52 90.05 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.5 0.667 . . . . 0.0 110.522 -178.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.536 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -59.33 -47.36 85.71 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 114.479 -1.237 . . . . 0.0 111.577 -179.295 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -63.33 -47.18 83.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.997 0.427 . . . . 0.0 110.895 -178.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -52.31 -54.22 34.24 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.066 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -64.72 -36.46 84.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.273 178.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.629 ' O ' HD23 ' A' ' 13' ' ' LEU . 24.9 t80 -61.41 -37.78 84.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.373 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.7 mm -68.71 -38.65 79.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.131 0.491 . . . . 0.0 110.264 177.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.8 m -69.53 -41.67 75.68 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.573 -177.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.509 ' SD ' ' HA ' ' A' ' 9' ' ' PHE . 24.1 ptm -69.11 -26.81 65.1 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 -179.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.629 HD23 ' O ' ' A' ' 9' ' ' PHE . 1.3 mm? -69.27 -38.31 78.31 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.36 179.038 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -70.89 -42.33 70.13 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.03 0.443 . . . . 0.0 110.531 174.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -69.34 -28.89 66.62 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.169 -176.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.412 HD22 ' N ' ' A' ' 16' ' ' ASN . 0.9 OUTLIER -85.81 8.65 19.2 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.929 0.395 . . . . 0.0 110.09 175.473 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 59.61 32.5 21.6 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 115.265 -0.879 . . . . 0.0 112.616 175.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.514 HG21 HD13 ' A' ' 13' ' ' LEU . 41.5 t -77.43 141.72 15.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.949 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -154.01 -159.71 1.01 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.95 172.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.705 ' HA ' HD22 ' A' ' 56' ' ' LEU . 16.9 m -60.25 -27.01 66.89 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -176.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 41.5 p -85.3 45.91 1.23 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 121.181 0.515 . . . . 0.0 111.563 -178.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.583 ' CE2' ' HD3' ' A' ' 26' ' ' ARG . 5.5 m95 -139.61 146.82 40.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.607 -177.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 93.7 p -105.12 170.22 8.0 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 170.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.445 ' CE1' ' HB3' ' A' ' 48' ' ' LYS . 61.4 t80 -85.2 15.37 4.28 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 122.133 0.968 . . . . 0.0 109.454 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.9 t -92.75 -41.02 10.36 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 113.859 -1.519 . . . . 0.0 107.335 172.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.583 ' HD3' ' CE2' ' A' ' 22' ' ' TRP . 18.1 ttt180 -65.74 -32.86 74.63 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 114.327 -1.306 . . . . 0.0 109.635 177.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.7 HG23 HD22 ' A' ' 31' ' ' LEU . 33.4 mt -63.08 -54.46 33.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.198 174.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.5 mt -62.37 -32.71 55.9 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 120.411 -0.515 . . . . 0.0 111.893 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 96.9 p -85.51 -37.89 19.17 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -174.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.479 ' HB3' ' HE ' ' A' ' 34' ' ' ARG . 40.0 mm-40 -101.56 -35.75 9.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.902 0.382 . . . . 0.0 111.497 -174.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.7 HD22 HG23 ' A' ' 27' ' ' ILE . 5.3 mp -86.43 -16.33 37.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.388 0.613 . . . . 0.0 109.662 -174.432 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -81.05 -3.79 90.62 Favored Glycine 0 N--CA 1.442 -0.933 0 CA-C-N 115.199 -0.909 . . . . 0.0 111.904 177.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 41.3 p -129.04 -38.25 1.64 Allowed 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -176.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.479 ' HE ' ' HB3' ' A' ' 30' ' ' GLU . 89.9 mtt-85 -54.84 -45.63 74.53 Favored 'General case' 0 C--O 1.232 0.174 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -176.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.461 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 2.8 p30 -155.92 138.95 10.75 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 172.429 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.497 ' O ' ' HG3' ' A' ' 40' ' ' MET . 16.7 Cg_exo -68.98 14.45 0.2 Allowed 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 123.457 2.771 . . . . 0.0 114.474 -171.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 43.3 mtm180 -63.35 -28.72 70.19 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 122.128 -0.357 . . . . 0.0 111.043 177.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -68.02 -17.44 64.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.387 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 56.2 m95 -106.95 -24.37 12.04 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.921 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.497 ' HG3' ' O ' ' A' ' 36' ' ' PRO . 89.2 mtp -56.14 -49.89 72.67 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 174.185 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.536 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 2.9 p -86.25 123.37 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.354 -0.839 . . . . 0.0 108.77 169.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -58.58 144.32 43.22 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-O 121.729 0.776 . . . . 0.0 111.275 -174.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -73.12 97.32 2.35 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 114.726 -1.124 . . . . 0.0 111.987 -171.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -103.05 97.98 10.76 Favored Pre-proline 0 C--N 1.318 -0.766 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 164.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.687 ' O ' ' HB3' ' A' ' 49' ' ' LYS . 17.3 Cg_exo -66.74 -22.21 50.23 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.302 2.001 . . . . 0.0 112.417 -172.51 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.414 HD22 ' HA ' ' A' ' 46' ' ' LEU . 0.3 OUTLIER -82.3 -37.82 25.24 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 179.586 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 45.4 t90 -74.68 -38.75 62.32 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.54 175.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.599 ' HG3' ' CZ ' ' A' ' 9' ' ' PHE . 1.4 mptm? -61.18 -32.41 72.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.035 0.445 . . . . 0.0 110.138 176.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.687 ' HB3' ' O ' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -88.59 -33.07 17.8 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.763 -176.493 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -62.9 -47.94 81.12 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.378 0.608 . . . . 0.0 110.257 171.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 1.5 ppp? -71.63 -24.12 61.81 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.032 -176.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.55 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 20.3 t80 -69.25 -36.45 77.16 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.095 174.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -65.9 -28.22 68.78 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.184 0.516 . . . . 0.0 109.943 174.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 10.1 tttm -72.58 -37.15 68.26 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.408 172.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.493 ' HA ' ' HA ' ' A' ' 59' ' ' ARG . 63.5 t80 -72.39 -18.8 61.7 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.125 0.488 . . . . 0.0 110.983 -179.114 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.705 HD22 ' HA ' ' A' ' 20' ' ' SER . 72.9 mt -92.28 -32.63 14.95 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 120.839 0.352 . . . . 0.0 111.073 176.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.3 t -85.68 -48.99 8.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.964 0.411 . . . . 0.0 110.754 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -102.6 -45.24 5.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.904 -179.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.493 ' HA ' ' HA ' ' A' ' 55' ' ' TYR . 40.3 ttm180 . . . . . 0 C--O 1.249 1.03 0 CA-C-O 117.957 -1.021 . . . . 0.0 110.733 178.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.54 ' O ' ' HG3' ' A' ' 7' ' ' LYS . 26.6 mmt . . . . . 0 CA--C 1.52 -0.182 0 CA-C-O 120.727 0.299 . . . . 0.0 111.248 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -68.76 -31.69 70.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.003 0.43 . . . . 0.0 109.963 -178.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.655 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -61.65 -44.47 96.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.723 176.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -61.45 -47.32 86.24 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 121.076 0.465 . . . . 0.0 110.466 175.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.54 ' HG3' ' O ' ' A' ' 3' ' ' MET . 48.9 mtpt -55.96 -49.48 73.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.405 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -65.04 -31.16 72.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.851 0.358 . . . . 0.0 110.949 178.083 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.48 ' HE2' ' HE2' ' A' ' 48' ' ' LYS . 1.4 t80 -69.84 -40.21 75.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.94 -179.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.5 mm -73.5 -37.16 49.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.185 0.517 . . . . 0.0 110.144 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 26.8 m -65.56 -31.97 73.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.402 176.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 24.0 ttp -75.06 -33.91 61.76 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 115.322 -0.853 . . . . 0.0 108.944 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.487 HD13 HG11 ' A' ' 18' ' ' VAL . 0.2 OUTLIER -68.85 -38.88 80.07 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.835 -179.017 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.4 mppt? -73.89 -32.55 63.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.871 0.367 . . . . 0.0 110.904 177.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -69.2 -20.62 63.98 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.585 176.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.408 ' OD1' ' HD3' ' A' ' 34' ' ' ARG . 39.0 m-80 -106.65 17.48 23.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.657 -0.247 . . . . 0.0 111.471 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.1 mm100 53.6 30.98 11.69 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.592 175.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.487 HG11 HD13 ' A' ' 13' ' ' LEU . 58.7 t -68.5 136.84 25.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.742 -177.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -148.62 -156.37 0.71 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.8 p -74.37 -15.07 60.94 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.003 -176.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.3 t -83.13 -3.45 57.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.412 0.625 . . . . 0.0 110.739 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.56 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 6.0 m95 -92.18 128.32 37.99 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.112 176.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 70.8 p -95.71 174.63 6.88 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.49 -0.929 . . . . 0.0 108.49 170.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.529 ' CD1' HD12 ' A' ' 27' ' ' ILE . 27.8 t80 -86.5 15.18 5.74 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.132 178.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.8 t -93.23 -33.14 14.09 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 113.897 -1.501 . . . . 0.0 107.211 171.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.56 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 31.6 ttt180 -72.58 -33.71 66.94 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.285 176.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.574 HG23 HD23 ' A' ' 31' ' ' LEU . 45.8 mt -65.12 -39.13 84.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.509 176.048 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 72.8 mt -76.27 -44.0 36.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 C-N-CA 119.594 -0.842 . . . . 0.0 111.572 173.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 99.0 p -74.38 -38.07 63.26 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -171.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.543 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 50.2 mm-40 -109.96 -37.64 5.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.224 0.535 . . . . 0.0 111.226 -177.08 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.574 HD23 HG23 ' A' ' 27' ' ' ILE . 11.6 tp -87.84 -12.78 43.91 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.857 -162.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -83.28 -15.68 71.13 Favored Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.47 -0.872 . . . . 0.0 111.719 176.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.4 p -120.28 -26.96 5.34 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.543 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 46.5 mtt180 -57.12 -40.01 76.23 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.618 0.247 . . . . 0.0 111.104 178.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.494 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 8.8 t70 -152.58 129.89 5.79 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.412 179.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.494 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 22.3 Cg_exo -66.37 -0.89 4.74 Favored 'Trans proline' 0 CA--C 1.531 0.357 0 C-N-CA 123.658 2.905 . . . . 0.0 113.824 -177.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.449 ' HE ' ' CG ' ' A' ' 35' ' ' ASP . 68.2 mtm180 -61.36 -21.27 63.88 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 175.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -68.07 -18.67 64.74 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.221 0.534 . . . . 0.0 109.795 175.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 53.5 m95 -104.35 -17.29 14.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.409 -176.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 32.6 tpp -60.84 -38.55 85.86 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 121.243 0.544 . . . . 0.0 109.564 176.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.655 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 7.2 p -93.61 139.36 18.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.123 171.355 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -64.6 145.69 55.79 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-O 121.727 0.775 . . . . 0.0 111.778 -176.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -68.39 96.68 0.69 Allowed 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.155 -1.384 . . . . 0.0 112.051 -171.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.506 ' O ' ' HD3' ' A' ' 48' ' ' LYS . 9.8 t70 -122.24 98.31 44.43 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 114.877 -1.056 . . . . 0.0 108.623 169.074 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -60.52 -32.49 93.65 Favored 'Trans proline' 0 CA--C 1.516 -0.409 0 C-N-CA 122.937 2.425 . . . . 0.0 112.758 -174.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.68 -38.35 58.77 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.952 -178.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . 0.542 ' CZ3' HG21 ' A' ' 41' ' ' VAL . 71.2 t90 -73.2 -36.6 66.55 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.896 -0.321 . . . . 0.0 110.147 174.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.506 ' HD3' ' O ' ' A' ' 44' ' ' ASP . 2.3 mptm? -61.07 -34.1 74.37 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.717 -0.393 . . . . 0.0 109.944 176.227 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.486 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 33.3 mttt -78.72 -40.66 32.97 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 120.875 0.369 . . . . 0.0 110.59 178.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -65.96 -43.41 88.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.414 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 2.8 ppp? -73.28 -29.02 62.44 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 -178.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -69.79 -37.95 76.51 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.423 176.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.486 ' HG3' ' O ' ' A' ' 49' ' ' LYS . 92.5 mt-10 -69.6 -26.5 64.48 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 175.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 40.8 tptt -72.98 -37.52 67.0 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.224 0.535 . . . . 0.0 109.618 174.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.439 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 80.1 t80 -63.18 -30.4 71.55 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.684 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 64.6 mt -89.97 -32.83 16.62 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.408 179.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.4 t -79.79 -48.71 13.13 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.878 0.37 . . . . 0.0 111.466 -178.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -100.79 -45.76 5.36 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.547 -176.106 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 55' ' ' TYR . 3.1 mmt180 . . . . . 0 C--O 1.249 1.066 0 O-C-N 123.89 0.744 . . . . 0.0 110.751 176.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 68.8 mtm . . . . . 0 CA--C 1.521 -0.154 0 CA-C-O 120.495 0.188 . . . . 0.0 110.886 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -57.07 -42.98 81.64 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.402 0.62 . . . . 0.0 109.934 175.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.603 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -60.43 -47.29 86.75 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 114.746 -1.115 . . . . 0.0 111.129 178.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -59.15 -49.71 76.84 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.107 0.479 . . . . 0.0 110.395 178.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.403 ' HD2' ' HA ' ' A' ' 7' ' ' LYS . 12.9 mmmm -54.54 -44.85 73.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.945 -179.262 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.453 ' HB3' ' HD3' ' A' ' 37' ' ' ARG . 40.9 mt-10 -75.88 -25.53 56.22 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.036 179.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -72.31 -39.9 67.9 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.828 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.624 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 39.2 mm -68.57 -38.73 79.52 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.222 0 CA-C-O 121.389 0.614 . . . . 0.0 109.939 177.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.0 m -67.62 -29.68 69.06 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.049 176.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 42.7 ttp -77.24 -29.43 54.07 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.334 -178.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.537 HD13 HG11 ' A' ' 18' ' ' VAL . 0.2 OUTLIER -71.21 -38.58 72.03 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.733 179.367 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.624 ' HD3' ' O ' ' A' ' 10' ' ' ILE . 0.3 OUTLIER -74.38 -31.89 62.54 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.691 176.775 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -63.43 -32.09 73.43 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.354 175.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -98.15 10.28 40.9 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.485 -177.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 55.4 mm-40 58.11 31.92 21.34 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.911 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.537 HG11 HD13 ' A' ' 13' ' ' LEU . 65.1 t -69.92 123.31 23.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.617 -176.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -142.07 -159.45 0.97 Allowed 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 170.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.5 t -59.02 -17.32 24.09 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -176.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.2 t -77.67 -3.78 42.79 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 122.133 -0.354 . . . . 0.0 111.414 178.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.522 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 7.8 m95 -99.43 138.1 37.0 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.234 176.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 87.7 p -110.5 178.91 4.23 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 170.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.536 ' CD1' HD12 ' A' ' 27' ' ' ILE . 15.9 t80 -86.14 16.69 4.1 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.999 0.904 . . . . 0.0 109.272 178.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.7 t -93.48 -38.18 11.55 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 169.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.522 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 29.3 ttt180 -71.56 -33.32 69.01 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 114.049 -1.432 . . . . 0.0 109.166 177.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.571 HG12 HD22 ' A' ' 31' ' ' LEU . 29.3 mt -64.92 -50.24 75.97 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.391 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.121 173.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 24' ' ' PHE . 44.6 mm -62.59 -43.19 98.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 119.822 -0.751 . . . . 0.0 111.198 177.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 48.4 t -70.58 -38.59 74.08 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -176.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.507 ' HB3' ' HE ' ' A' ' 34' ' ' ARG . 20.4 mm-40 -113.83 -34.95 5.29 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -171.196 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.571 HD22 HG12 ' A' ' 27' ' ' ILE . 0.5 OUTLIER -87.65 -26.36 23.06 Favored 'General case' 0 C--N 1.319 -0.754 0 O-C-N 121.771 -0.581 . . . . 0.0 111.01 -175.106 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -86.1 9.19 70.5 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.707 -0.759 . . . . 0.0 111.518 175.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 46.0 p -132.02 -54.0 0.98 Allowed 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -177.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.507 ' HE ' ' HB3' ' A' ' 30' ' ' GLU . 65.9 mtt-85 -52.87 -46.06 67.74 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -177.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.503 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 9.3 t70 -139.21 132.84 15.86 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.999 -171.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.503 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 17.3 Cg_exo -68.29 -2.21 8.6 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 123.32 2.68 . . . . 0.0 113.35 -178.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.474 ' HE ' ' CG ' ' A' ' 35' ' ' ASP . 48.0 mtm180 -56.13 -30.32 61.96 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 176.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.403 ' CE1' ' HD2' ' A' ' 48' ' ' LYS . 67.7 t80 -69.5 -21.76 63.65 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.767 0.318 . . . . 0.0 110.393 178.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 62.6 m95 -104.08 -19.98 13.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.93 -174.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.455 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 38.2 mtm -60.8 -39.64 89.66 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.474 0.654 . . . . 0.0 109.559 177.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.603 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 5.2 p -88.38 130.65 37.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.102 -0.953 . . . . 0.0 108.664 169.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.23 136.74 58.05 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-O 121.447 0.642 . . . . 0.0 109.637 178.061 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.407 ' O ' ' HD3' ' A' ' 45' ' ' PRO . 29.5 t70 -75.88 96.47 3.72 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 114.882 -1.053 . . . . 0.0 112.091 -166.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -100.84 95.91 5.02 Favored Pre-proline 0 C--N 1.321 -0.643 0 N-CA-C 107.113 -1.439 . . . . 0.0 107.113 165.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.661 ' HA ' ' HB2' ' A' ' 48' ' ' LYS . 19.4 Cg_exo -67.11 -23.56 45.8 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 122.421 2.08 . . . . 0.0 112.107 -171.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -71.24 -38.32 71.95 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 56.4 t90 -75.72 -38.27 58.7 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 172.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.661 ' HB2' ' HA ' ' A' ' 45' ' ' PRO . 27.0 mmtp -61.01 -35.81 77.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.328 179.171 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.531 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 43.8 mttt -80.38 -40.29 26.81 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.669 179.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -66.14 -37.95 86.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.321 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 1.3 ppp? -71.73 -32.85 68.18 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.497 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 35.6 t80 -71.01 -37.96 72.65 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.665 176.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.531 ' HG2' ' O ' ' A' ' 49' ' ' LYS . 24.2 mm-40 -66.51 -30.84 71.25 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 175.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -72.45 -37.96 68.4 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.2 178.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.685 ' HA ' ' HA ' ' A' ' 59' ' ' ARG . 75.7 t80 -70.98 -24.51 62.41 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.75 -177.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 82.8 mt -87.95 -34.02 18.24 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.791 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.6 p -86.35 -41.11 14.79 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.952 0.406 . . . . 0.0 111.407 -178.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -118.13 -42.17 2.82 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.163 -176.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.685 ' HA ' ' HA ' ' A' ' 55' ' ' TYR . 39.0 ttm180 . . . . . 0 C--O 1.247 0.943 0 CA-C-O 118.123 -0.942 . . . . 0.0 110.378 -177.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.489 ' O ' ' HG2' ' A' ' 7' ' ' LYS . 34.4 mmt . . . . . 0 CA--C 1.518 -0.264 0 CA-C-O 120.631 0.253 . . . . 0.0 110.336 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -68.15 -35.0 77.36 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 176.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.501 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -64.25 -41.21 97.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.388 175.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.512 ' O ' HG12 ' A' ' 10' ' ' ILE . 29.8 tt0 -57.39 -47.03 82.74 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.038 176.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.565 ' HE2' ' N ' ' A' ' 7' ' ' LYS . 9.4 mmpt? -52.5 -52.35 54.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.446 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -62.78 -39.02 92.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.551 178.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.525 ' CE2' ' HG3' ' A' ' 48' ' ' LYS . 16.2 t80 -63.11 -39.48 94.81 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.465 -178.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.595 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 47.4 mm -74.31 -37.11 44.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.183 0.516 . . . . 0.0 110.226 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 29.9 m -64.11 -34.82 78.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.597 0.713 . . . . 0.0 110.289 176.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 33.4 ttp -75.93 -30.68 58.8 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.281 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.452 HD13 HG11 ' A' ' 18' ' ' VAL . 0.1 OUTLIER -70.36 -38.41 74.77 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.042 179.128 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.595 ' HD3' ' O ' ' A' ' 10' ' ' ILE . 0.0 OUTLIER -72.18 -33.48 67.7 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.756 0.313 . . . . 0.0 110.485 176.258 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -66.19 -26.76 67.55 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 121.288 0.566 . . . . 0.0 111.511 176.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 -102.02 14.57 31.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.785 -177.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 53.95 31.42 13.39 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.849 175.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.452 HG11 HD13 ' A' ' 13' ' ' LEU . 66.4 t -67.12 136.06 27.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.245 0.545 . . . . 0.0 111.634 -173.082 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -157.94 -160.21 0.89 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.349 175.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 p -55.51 -24.39 31.47 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 123.383 0.427 . . . . 0.0 112.098 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.6 p -69.96 -11.17 60.67 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 120.972 0.415 . . . . 0.0 112.0 -179.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.579 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 11.5 m95 -95.75 133.83 39.39 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.169 0.509 . . . . 0.0 110.969 179.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 m -105.86 168.54 9.05 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 168.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.583 ' CD1' HD12 ' A' ' 27' ' ' ILE . 18.9 t80 -82.5 15.78 2.39 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 122.087 0.946 . . . . 0.0 109.912 -176.261 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.6 t -92.84 -34.3 13.89 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.173 -1.376 . . . . 0.0 107.674 170.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.579 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 40.8 ttt180 -70.14 -36.14 74.56 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.618 -1.174 . . . . 0.0 108.99 178.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.61 HG23 HD23 ' A' ' 31' ' ' LEU . 52.4 mt -64.77 -47.14 89.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.334 176.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.6 mt -70.51 -42.79 78.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 C-N-CA 119.546 -0.861 . . . . 0.0 111.705 177.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.3 t -77.55 -39.02 47.35 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -171.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 22.9 mm-40 -111.52 -35.39 5.81 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 121.077 0.465 . . . . 0.0 111.345 -174.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.61 HD23 HG23 ' A' ' 27' ' ' ILE . 11.4 tp -84.87 -36.67 21.39 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.478 -168.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -68.07 -17.42 69.83 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.763 174.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 65.1 p -107.1 -1.9 21.54 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 122.452 -0.44 . . . . 0.0 111.564 -178.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 60.3 mtt-85 -88.99 -47.37 8.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.542 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.495 ' OD1' ' HG3' ' A' ' 37' ' ' ARG . 11.8 t70 -149.32 137.41 11.71 Favored Pre-proline 0 C--N 1.325 -0.469 0 C-N-CA 120.904 -0.319 . . . . 0.0 111.222 -172.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.521 ' HA ' ' HD1' ' A' ' 39' ' ' TRP . 34.2 Cg_exo -63.32 -7.02 11.15 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.681 2.92 . . . . 0.0 113.959 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.495 ' HG3' ' OD1' ' A' ' 35' ' ' ASP . 47.0 mtm180 -56.41 -28.79 60.4 Favored 'General case' 0 CA--C 1.529 0.146 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 174.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -71.96 -20.27 61.76 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.816 0.341 . . . . 0.0 110.686 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.521 ' HD1' ' HA ' ' A' ' 36' ' ' PRO . 56.7 m95 -106.81 -23.53 12.36 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.436 -175.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 39.3 ttm -51.91 -47.3 64.68 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 121.36 0.6 . . . . 0.0 109.951 175.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.501 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 2.5 p -87.43 116.67 30.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 167.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -58.19 145.42 37.23 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 121.464 0.649 . . . . 0.0 110.98 -173.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -63.33 98.09 0.15 Allowed 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.25 -1.341 . . . . 0.0 113.909 -164.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -111.11 95.94 27.65 Favored Pre-proline 0 N--CA 1.426 -1.628 0 CA-C-N 113.121 -1.854 . . . . 0.0 108.97 166.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_exo -67.71 -32.87 29.28 Favored 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 122.663 2.242 . . . . 0.0 112.662 -173.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.681 ' HA ' ' HE3' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -70.63 -36.39 73.44 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.881 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . 0.496 ' O ' ' HG2' ' A' ' 51' ' ' MET . 39.6 t90 -74.2 -39.27 63.26 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 119.608 -0.837 . . . . 0.0 110.111 175.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.525 ' HG3' ' CE2' ' A' ' 9' ' ' PHE . 0.0 OUTLIER -63.83 -32.77 74.39 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 176.312 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.681 ' HE3' ' HA ' ' A' ' 46' ' ' LEU . 12.0 ptpt -78.72 -38.59 38.62 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.136 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -68.52 -42.03 79.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.642 179.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.496 ' HG2' ' O ' ' A' ' 47' ' ' TRP . 15.6 ptm -74.22 -26.65 60.38 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.54 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 39.8 t80 -70.33 -37.15 74.63 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-N 115.938 -0.573 . . . . 0.0 109.605 175.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -66.57 -30.85 71.25 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.941 175.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -72.85 -37.39 67.43 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-O 121.353 0.597 . . . . 0.0 109.904 177.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.437 ' HE2' ' O ' ' A' ' 18' ' ' VAL . 75.1 t80 -71.49 -24.71 62.03 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.643 -178.094 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 40.2 mt -93.7 -33.47 13.63 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.369 178.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 21.2 t -100.06 25.06 7.8 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.36 0.6 . . . . 0.0 110.664 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -171.11 -66.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.051 177.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.426 ' HB2' ' O ' ' A' ' 55' ' ' TYR . 36.6 ttm180 . . . . . 0 C--O 1.249 1.038 0 O-C-N 124.333 1.02 . . . . 0.0 109.543 -172.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 18.6 ttt . . . . . 0 N--CA 1.448 -0.559 0 CA-C-O 121.583 0.706 . . . . 0.0 110.007 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -62.7 -44.04 97.26 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.028 178.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.674 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -60.31 -45.03 94.81 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.24 177.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.452 ' O ' HG12 ' A' ' 10' ' ' ILE . 29.2 tt0 -57.34 -54.39 47.38 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 121.131 0.491 . . . . 0.0 110.254 177.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.1 ttpt -50.15 -50.35 49.19 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.009 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -61.09 -40.18 92.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.046 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.62 ' CZ ' ' HG3' ' A' ' 48' ' ' LYS . 25.4 t80 -67.38 -40.1 85.68 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.91 -177.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.453 HG22 ' HE3' ' A' ' 14' ' ' LYS . 40.1 mm -74.88 -36.34 38.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.28 0.562 . . . . 0.0 110.284 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.4 m -71.38 -28.11 63.8 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.406 177.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.482 ' SD ' ' HB3' ' A' ' 35' ' ' ASP . 27.2 ttp -74.47 -34.6 63.16 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 177.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.437 HD13 HG11 ' A' ' 18' ' ' VAL . 0.1 OUTLIER -68.59 -38.03 80.31 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.04 178.396 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.453 ' HE3' HG22 ' A' ' 10' ' ' ILE . 33.6 mttt -68.81 -43.15 76.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.205 0.526 . . . . 0.0 111.04 176.504 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -66.08 -29.64 70.01 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.025 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -91.68 11.19 25.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.657 0.265 . . . . 0.0 111.087 177.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 55.29 31.84 17.43 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.535 176.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.437 HG11 HD13 ' A' ' 13' ' ' LEU . 58.7 t -65.73 130.04 30.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.405 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -140.87 -164.15 1.68 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.429 176.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.2 p -56.21 -28.31 57.85 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -178.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 79.6 p -75.39 -6.77 51.7 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.027 0.441 . . . . 0.0 111.999 -176.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.747 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 9.8 m95 -89.38 126.08 35.4 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.112 0.482 . . . . 0.0 111.442 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.433 ' C ' ' H ' ' A' ' 25' ' ' SER . 30.4 t -83.89 155.65 22.79 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 167.54 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.576 ' CZ ' ' HB3' ' A' ' 48' ' ' LYS . 91.0 t80 -81.0 15.35 1.87 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-O 122.709 1.242 . . . . 0.0 109.356 -179.026 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.433 ' H ' ' C ' ' A' ' 23' ' ' SER . 15.1 t -92.28 -30.72 15.71 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 113.136 -1.847 . . . . 0.0 107.366 171.342 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.747 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 62.7 ttt180 -73.49 -37.63 65.66 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 114.478 -1.237 . . . . 0.0 109.59 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.55 ' O ' ' HB2' ' A' ' 31' ' ' LEU . 64.5 mt -63.12 -52.33 60.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.615 175.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 76.6 mt -61.11 -42.16 92.15 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 120.069 -0.652 . . . . 0.0 111.27 178.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.2 t -77.97 -39.13 43.51 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -172.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.578 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 12.8 mt-10 -107.33 -37.07 6.34 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.973 -0.691 . . . . 0.0 111.993 -176.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.55 ' HB2' ' O ' ' A' ' 27' ' ' ILE . 1.2 mp -78.13 -31.11 49.69 Favored 'General case' 0 C--N 1.323 -0.566 0 O-C-N 122.025 -0.422 . . . . 0.0 111.315 -172.034 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.11 -32.84 67.82 Favored Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.546 176.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.7 t -104.32 -19.39 14.1 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -178.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.578 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 62.2 mtt-85 -74.63 -34.39 62.77 Favored 'General case' 0 CA--C 1.517 -0.302 0 O-C-N 122.316 -0.24 . . . . 0.0 111.628 179.216 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.482 ' HB3' ' SD ' ' A' ' 12' ' ' MET . 8.7 t0 -147.76 129.78 7.53 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-O 120.994 0.426 . . . . 0.0 111.087 -175.397 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 16.9 Cg_exo -68.71 -6.0 16.81 Favored 'Trans proline' 0 CA--C 1.529 0.251 0 C-N-CA 123.363 2.708 . . . . 0.0 112.795 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.548 ' HA ' ' HG2' ' A' ' 40' ' ' MET . 51.9 mtt180 -61.69 -25.08 67.18 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.625 0.231 . . . . 0.0 111.625 176.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -68.13 -21.64 64.92 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 176.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 48.6 m95 -99.36 -17.13 18.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.485 -177.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.548 ' HG2' ' HA ' ' A' ' 37' ' ' ARG . 86.2 mmm -49.61 -38.62 32.52 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.317 0.579 . . . . 0.0 110.564 175.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.674 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 3.5 p -113.07 129.95 67.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.084 173.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.45 143.12 50.8 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-O 121.45 0.643 . . . . 0.0 109.714 177.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.464 ' O ' ' HD3' ' A' ' 45' ' ' PRO . 25.6 t0 -76.79 99.31 5.09 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.05 -0.977 . . . . 0.0 113.153 -160.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -96.22 99.26 5.01 Favored Pre-proline 0 C--N 1.324 -0.536 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 166.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.464 ' HD3' ' O ' ' A' ' 43' ' ' ASP . 37.6 Cg_exo -62.38 -30.32 80.48 Favored 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 122.934 2.423 . . . . 0.0 112.765 -174.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.461 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 1.1 tm? -71.18 -39.03 72.1 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.219 -0.659 . . . . 0.0 109.219 -179.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . 0.455 ' O ' ' HG2' ' A' ' 51' ' ' MET . 42.5 t90 -75.2 -38.53 60.7 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.454 176.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.62 ' HG3' ' CZ ' ' A' ' 9' ' ' PHE . 2.1 mptm? -62.83 -33.99 76.39 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.628 177.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.426 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 33.4 mttt -75.37 -38.75 59.83 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.477 176.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.461 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 32.3 mt-10 -62.37 -47.48 84.0 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.264 177.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.455 ' HG2' ' O ' ' A' ' 47' ' ' TRP . 13.5 ptm -73.13 -22.74 60.47 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.098 -176.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.505 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 24.0 t80 -76.97 -38.43 53.26 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.53 176.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 49' ' ' LYS . 47.2 mm-40 -67.31 -33.83 76.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.924 0.393 . . . . 0.0 110.019 176.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.2 tttt -72.32 -37.73 68.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.866 175.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -61.85 -31.75 72.04 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.52 178.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 83.1 mt -84.15 -33.28 24.29 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -178.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 72.4 p -106.26 9.16 32.13 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -175.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.48 ' O ' ' HB2' ' A' ' 59' ' ' ARG . 0.2 OUTLIER -153.09 -49.79 0.1 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.741 -0.209 . . . . 0.0 110.498 -176.759 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.48 ' HB2' ' O ' ' A' ' 58' ' ' ASN . 50.9 mtt180 . . . . . 0 C--O 1.247 0.931 0 O-C-N 124.113 0.883 . . . . 0.0 110.168 -178.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.427 ' O ' ' HG3' ' A' ' 7' ' ' LYS . 65.0 mtm . . . . . 0 CA--C 1.517 -0.289 0 CA-C-O 121.16 0.505 . . . . 0.0 109.997 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -58.49 -56.56 20.61 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.963 -175.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.604 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -64.67 -34.44 78.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.647 -176.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.769 ' HG3' ' HE3' ' A' ' 51' ' ' MET . 34.6 tt0 -62.99 -52.87 61.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.898 0.38 . . . . 0.0 110.025 178.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.427 ' HG3' ' O ' ' A' ' 3' ' ' MET . 45.8 mtpt -64.33 -35.91 82.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.689 -179.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -61.66 -37.78 85.33 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.938 0.399 . . . . 0.0 110.185 174.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.572 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 30.3 t80 -71.43 -39.28 71.15 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.32 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 6' ' ' GLU . 47.5 mm -71.39 -37.7 66.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.281 0.562 . . . . 0.0 110.399 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 38.9 m -72.77 -24.37 60.94 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.193 175.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.761 ' HB2' ' HD2' ' A' ' 37' ' ' ARG . 46.7 ttp -75.18 -33.14 61.41 Favored 'General case' 0 CA--C 1.509 -0.611 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 178.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 9' ' ' PHE . 80.1 mt -68.06 -38.3 82.3 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.108 176.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 62.7 mttt -69.55 -40.38 76.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.256 0.551 . . . . 0.0 111.039 176.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -73.97 -13.32 60.86 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.823 179.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.544 ' OD1' ' HD2' ' A' ' 34' ' ' ARG . 0.9 OUTLIER -106.66 10.82 30.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.841 0.353 . . . . 0.0 110.644 177.546 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 41.9 mm-40 56.37 31.83 19.43 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.014 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.481 HG11 HD22 ' A' ' 13' ' ' LEU . 58.3 t -75.71 140.95 16.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.786 -178.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -157.94 -158.81 0.76 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.026 -0.533 . . . . 0.0 109.597 172.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.7 p -51.23 -32.25 23.52 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.1 t -85.32 25.86 0.96 Allowed 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.42 0.628 . . . . 0.0 111.88 -174.154 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.675 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 3.6 m95 -115.89 140.73 48.95 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.955 0.407 . . . . 0.0 110.873 178.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 84.9 p -97.08 168.49 10.42 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 173.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.472 ' CD1' HD12 ' A' ' 27' ' ' ILE . 41.7 t80 -89.04 15.75 8.19 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 122.172 0.987 . . . . 0.0 108.957 177.081 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.0 m -94.14 -42.9 8.74 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 113.842 -1.526 . . . . 0.0 107.462 170.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.675 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 19.7 ttt180 -60.58 -38.05 83.32 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 113.57 -1.65 . . . . 0.0 109.437 174.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.776 HG23 HD22 ' A' ' 31' ' ' LEU . 50.7 mt -61.15 -58.25 8.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.64 175.223 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 71.3 mt -60.18 -34.78 58.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.543 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.4 t -79.24 -38.85 34.61 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -174.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 26.8 mm-40 -104.05 -34.55 8.39 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 -173.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.776 HD22 HG23 ' A' ' 27' ' ' ILE . 5.1 mp -86.47 -15.06 41.33 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.434 0.635 . . . . 0.0 109.725 -176.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -83.34 -5.53 88.67 Favored Glycine 0 N--CA 1.439 -1.108 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.275 174.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 23.7 p -128.02 -45.44 1.41 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -175.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.544 ' HD2' ' OD1' ' A' ' 16' ' ' ASN . 47.1 mtt180 -53.5 -44.86 69.4 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -177.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.441 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 16.6 t70 -160.34 129.44 3.15 Favored Pre-proline 0 C--N 1.323 -0.559 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 177.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.505 ' O ' ' HG3' ' A' ' 40' ' ' MET . 16.3 Cg_exo -69.46 27.56 0.17 Allowed 'Trans proline' 0 CA--C 1.533 0.438 0 C-N-CA 123.577 2.852 . . . . 0.0 114.851 -171.241 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.761 ' HD2' ' HB2' ' A' ' 12' ' ' MET . 87.1 mtt180 -65.5 -28.42 69.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.122 0.487 . . . . 0.0 110.142 176.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.429 ' CE1' ' HD2' ' A' ' 48' ' ' LYS . 49.9 t80 -69.26 -20.57 63.93 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.461 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 46.4 m95 -103.63 -28.64 11.59 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.524 -175.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.581 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 47.9 mtm -55.56 -41.5 73.37 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.178 0.514 . . . . 0.0 110.207 178.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.604 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 3.4 p -89.91 123.08 41.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 169.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -58.86 143.8 46.41 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-O 121.68 0.752 . . . . 0.0 110.671 -176.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -75.37 98.29 3.82 Favored 'General case' 0 N--CA 1.436 -1.129 0 CA-C-N 114.667 -1.151 . . . . 0.0 113.594 -163.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -106.0 95.97 11.99 Favored Pre-proline 0 C--N 1.317 -0.818 0 N-CA-C 106.868 -1.531 . . . . 0.0 106.868 158.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.852 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 25.9 Cg_exo -62.68 -37.37 57.45 Favored 'Trans proline' 0 N--CA 1.449 -1.147 0 C-N-CA 121.997 1.798 . . . . 0.0 111.997 -173.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.484 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -61.4 -38.75 88.22 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.228 -179.822 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 48.4 t90 -69.25 -38.34 78.41 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-O 120.875 0.369 . . . . 0.0 110.038 173.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.429 ' HD2' ' CE1' ' A' ' 38' ' ' TYR . 23.4 mmtp -60.6 -33.36 72.62 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.363 177.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.852 ' HG3' ' O ' ' A' ' 45' ' ' PRO . 31.7 mtpt -82.54 -38.44 23.74 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.236 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 42.9 mt-10 -61.84 -39.02 90.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.285 0.564 . . . . 0.0 111.271 176.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.769 ' HE3' ' HG3' ' A' ' 6' ' ' GLU . 17.6 ptm -78.79 -26.96 44.45 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-O 121.217 0.532 . . . . 0.0 109.767 -178.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.517 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 33.7 t80 -71.36 -39.28 71.39 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.155 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -74.39 -22.16 59.31 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.546 0.689 . . . . 0.0 109.464 177.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.7 tptm -71.09 -37.51 72.42 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.49 172.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -68.16 -25.84 65.46 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.628 178.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 58.7 mt -86.43 -32.53 20.82 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.309 178.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -89.91 -49.21 6.74 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.131 0.491 . . . . 0.0 110.961 -177.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -86.36 -56.29 3.51 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.74 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 . . . . . 0 C--O 1.247 0.935 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.575 -179.522 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 29.6 ttp . . . . . 0 N--CA 1.45 -0.448 0 CA-C-O 121.12 0.486 . . . . 0.0 110.081 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -66.37 -44.51 82.93 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.846 178.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.429 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -60.03 -42.15 93.76 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.582 176.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -57.97 -46.71 84.7 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.798 177.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.484 ' HE2' ' HA ' ' A' ' 7' ' ' LYS . 5.8 mmpt? -48.72 -57.7 5.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.341 179.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.486 ' HB3' ' HD2' ' A' ' 37' ' ' ARG . 28.2 mt-10 -73.4 -29.85 62.87 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.53 -178.337 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.583 ' HE2' ' HE2' ' A' ' 48' ' ' LYS . 0.4 OUTLIER -58.98 -40.62 85.36 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 177.81 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.537 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 33.4 mm -71.56 -37.08 62.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.339 0.59 . . . . 0.0 110.354 177.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 23.1 m -64.2 -40.8 96.82 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.301 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.471 ' HG2' ' O ' ' A' ' 8' ' ' GLU . 16.4 ptm -75.68 -23.63 56.23 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -177.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 9' ' ' PHE . 85.2 mt -68.77 -39.89 79.98 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.628 174.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.537 ' HD3' ' O ' ' A' ' 10' ' ' ILE . 0.1 OUTLIER -71.56 -39.78 70.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.394 0.616 . . . . 0.0 110.422 177.126 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -75.45 -14.17 60.42 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.597 -0.729 . . . . 0.0 112.546 -175.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.431 ' HA ' HD22 ' A' ' 16' ' ' ASN . 0.8 OUTLIER -107.87 20.18 19.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.834 0.35 . . . . 0.0 110.928 176.274 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 59.79 31.64 20.91 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.339 175.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.493 HG22 ' CE2' ' A' ' 22' ' ' TRP . 51.6 t -78.15 128.85 38.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.029 0.442 . . . . 0.0 111.264 -177.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -150.34 -157.46 0.82 Allowed 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 171.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.8 m -65.46 -9.02 22.07 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.5 p -79.06 -16.92 56.11 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 121.019 0.438 . . . . 0.0 111.199 176.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.597 ' CE2' ' HD3' ' A' ' 26' ' ' ARG . 7.2 m95 -86.86 119.69 27.35 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.281 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.401 ' C ' ' H ' ' A' ' 25' ' ' SER . 5.5 m -83.93 165.49 18.64 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 168.574 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.563 ' CD1' HD12 ' A' ' 27' ' ' ILE . 29.3 t80 -82.46 16.48 2.08 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 122.454 1.121 . . . . 0.0 109.577 -175.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.401 ' H ' ' C ' ' A' ' 23' ' ' SER . 48.1 t -91.4 -31.59 15.97 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-N 113.673 -1.603 . . . . 0.0 107.452 172.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.597 ' HD3' ' CE2' ' A' ' 22' ' ' TRP . 28.7 ttt180 -75.05 -33.32 61.71 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.846 179.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.563 HD12 ' CD1' ' A' ' 24' ' ' PHE . 54.2 mt -66.15 -42.3 90.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.175 176.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.6 mt -74.58 -43.36 48.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 119.561 -0.855 . . . . 0.0 111.808 175.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.2 t -82.4 -38.87 23.47 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -169.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.815 ' O ' ' HB2' ' A' ' 34' ' ' ARG . 28.9 mm-40 -103.89 -35.77 8.03 Favored 'General case' 0 C--O 1.212 -0.902 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.319 -176.701 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.554 HD23 HG23 ' A' ' 27' ' ' ILE . 8.9 tp -87.57 -36.27 17.64 Favored 'General case' 0 C--N 1.315 -0.91 0 O-C-N 123.569 0.543 . . . . 0.0 111.153 -167.049 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.48 -49.35 79.55 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.297 177.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 68.8 p -83.41 -10.08 58.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.048 0.451 . . . . 0.0 111.64 -177.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.815 ' HB2' ' O ' ' A' ' 30' ' ' GLU . 53.2 ttm-85 -83.31 -45.16 14.1 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.051 -177.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.444 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 8.0 t70 -138.09 128.23 15.24 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.583 -176.36 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 20.6 Cg_exo -66.87 -13.06 38.48 Favored 'Trans proline' 0 N--CA 1.465 -0.168 0 C-N-CA 123.517 2.811 . . . . 0.0 113.269 -178.058 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.523 ' HA ' ' HB2' ' A' ' 40' ' ' MET . 79.7 mtm180 -64.54 -19.45 65.63 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -70.3 -24.44 63.02 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 121.082 0.467 . . . . 0.0 109.881 175.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 53.9 m95 -101.6 -18.86 15.71 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.768 -178.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.523 ' HB2' ' HA ' ' A' ' 37' ' ' ARG . 18.3 ttp -52.55 -46.51 66.82 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 121.407 0.622 . . . . 0.0 109.778 175.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.429 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 7.6 p -89.19 133.97 29.83 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 168.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.4 143.01 50.95 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-O 121.334 0.588 . . . . 0.0 109.829 177.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -82.53 97.52 8.48 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.892 -165.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -103.26 101.41 22.29 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 114.691 -1.14 . . . . 0.0 108.45 170.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -59.23 -25.56 78.62 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.872 2.382 . . . . 0.0 112.574 -176.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.411 ' HA ' HD22 ' A' ' 46' ' ' LEU . 0.7 OUTLIER -75.47 -39.3 58.87 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 -179.795 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 47.1 t90 -75.52 -38.38 59.44 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.567 176.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.583 ' HE2' ' HE2' ' A' ' 9' ' ' PHE . 2.8 mptm? -62.66 -33.23 74.62 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 176.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.406 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 24.9 mttm -75.73 -41.43 53.39 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 120.975 -0.29 . . . . 0.0 110.833 176.242 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -61.55 -48.15 82.32 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.226 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 3.5 ppp? -75.28 -27.69 59.49 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.787 -174.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.617 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 35.3 t80 -74.59 -38.97 62.47 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.678 178.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 49' ' ' LYS . 45.2 mt-10 -73.0 -23.05 60.59 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 176.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 31.8 tptt -73.22 -38.45 66.06 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.522 0.677 . . . . 0.0 109.456 172.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.713 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 61.7 t80 -71.75 -23.06 61.54 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.666 -177.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.617 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 56.3 mt -89.5 -33.8 16.64 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.961 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -95.72 -53.32 3.75 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.887 0.375 . . . . 0.0 110.805 -176.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.402 HD22 ' HA ' ' A' ' 58' ' ' ASN . 2.1 t-20 -75.11 -53.38 8.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.018 178.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.713 ' HG2' ' O ' ' A' ' 55' ' ' TYR . 77.1 mtt180 . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.438 -178.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 83.1 mtp . . . . . 0 C--O 1.236 0.389 0 CA-C-O 121.025 0.44 . . . . 0.0 109.952 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.582 ' O ' ' HG3' ' A' ' 8' ' ' GLU . 23.1 mt-10 -64.1 -40.59 96.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.941 176.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.679 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -63.22 -35.69 81.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.685 -178.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.54 ' O ' HG12 ' A' ' 10' ' ' ILE . 32.6 tt0 -58.8 -51.26 70.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.352 0.596 . . . . 0.0 109.849 174.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.432 ' HE2' ' HB3' ' A' ' 7' ' ' LYS . 51.1 mtpt -63.03 -39.33 94.44 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.012 -179.099 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.582 ' HG3' ' O ' ' A' ' 4' ' ' GLU . 42.5 mt-10 -63.36 -40.23 96.69 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 120.904 0.383 . . . . 0.0 110.066 176.076 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.45 ' HA ' ' HG2' ' A' ' 12' ' ' MET . 48.2 t80 -60.75 -37.83 83.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.104 176.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.628 ' O ' ' HD2' ' A' ' 14' ' ' LYS . 41.0 mm -71.81 -37.08 60.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.387 178.194 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.6 m -66.67 -40.55 88.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.486 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.528 ' SD ' ' HB3' ' A' ' 37' ' ' ARG . 24.3 ptm -73.41 -22.24 60.28 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.512 HD23 ' HG3' ' A' ' 12' ' ' MET . 0.1 OUTLIER -70.45 -37.83 74.39 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.335 176.563 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.628 ' HD2' ' O ' ' A' ' 10' ' ' ILE . 3.8 mptt -68.16 -37.71 81.3 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.321 0.582 . . . . 0.0 109.847 173.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -66.21 -36.78 83.94 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.95 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -88.95 10.12 22.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.056 -179.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 61.71 31.79 18.48 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.37 176.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.479 HG11 HD13 ' A' ' 13' ' ' LEU . 40.2 t -75.75 139.47 18.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.682 0.277 . . . . 0.0 110.871 -177.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.469 ' OD1' HG22 ' A' ' 21' ' ' THR . 4.5 p-10 -156.4 -161.02 1.05 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.023 175.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.686 ' HA ' HD22 ' A' ' 56' ' ' LEU . 69.3 m -60.39 -30.52 69.64 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -175.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.469 HG22 ' OD1' ' A' ' 19' ' ' ASP . 13.2 t -81.19 11.31 4.34 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.991 0.424 . . . . 0.0 111.935 -175.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.449 ' CH2' HD11 ' A' ' 31' ' ' LEU . 5.3 m95 -96.67 138.87 33.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.201 0.525 . . . . 0.0 111.56 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -97.03 154.85 17.07 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 171.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.467 ' HD1' HD12 ' A' ' 27' ' ' ILE . 67.2 t80 -86.19 14.96 5.62 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 122.196 0.998 . . . . 0.0 110.358 -175.303 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.0 m -93.31 -33.31 13.96 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 114.315 -1.311 . . . . 0.0 107.581 168.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -70.13 -36.91 75.12 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 114.05 -1.432 . . . . 0.0 109.512 176.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.725 HG23 HD22 ' A' ' 31' ' ' LEU . 28.4 mt -61.1 -54.95 28.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.244 173.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 68.4 mt -61.55 -37.1 77.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 120.022 -0.671 . . . . 0.0 111.459 179.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.8 t -79.29 -40.94 29.21 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -173.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -99.86 -34.14 10.26 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.851 -175.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.725 HD22 HG23 ' A' ' 27' ' ' ILE . 4.2 mp -84.47 -23.51 29.86 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 -176.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -76.45 -13.34 83.51 Favored Glycine 0 N--CA 1.444 -0.814 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.588 174.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.4 p -114.58 -45.94 2.98 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 -176.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 90.1 mtt-85 -56.38 -44.69 80.46 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -177.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.444 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 9.7 t70 -145.91 130.64 8.93 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-O 120.829 0.347 . . . . 0.0 111.067 -173.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 24.5 Cg_exo -64.66 -4.99 9.39 Favored 'Trans proline' 0 CA--C 1.531 0.375 0 C-N-CA 123.6 2.866 . . . . 0.0 113.744 -178.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.528 ' HB3' ' SD ' ' A' ' 12' ' ' MET . 13.3 mtm180 -55.28 -28.64 54.82 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 176.074 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 70.9 t80 -68.64 -20.21 64.46 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.001 0.429 . . . . 0.0 110.133 178.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 58.7 m95 -107.05 -21.95 12.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.241 -177.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 85.0 mtp -58.17 -42.48 86.13 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.442 0.639 . . . . 0.0 109.341 174.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.679 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 6.7 p -86.21 132.01 33.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.328 -0.851 . . . . 0.0 108.842 169.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.19 143.58 48.54 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-O 121.482 0.658 . . . . 0.0 110.282 179.176 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -94.03 97.71 10.51 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.385 -166.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -105.88 97.83 16.39 Favored Pre-proline 0 N--CA 1.442 -0.862 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 163.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.62 ' HA ' ' HB2' ' A' ' 48' ' ' LYS . 24.2 Cg_exo -63.1 -22.37 73.18 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.65 2.234 . . . . 0.0 112.474 -171.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -74.78 -39.27 61.84 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 177.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . 0.404 ' O ' ' HG2' ' A' ' 51' ' ' MET . 45.3 t90 -72.93 -38.36 66.86 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 173.378 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.62 ' HB2' ' HA ' ' A' ' 45' ' ' PRO . 24.8 mmtp -59.78 -33.66 71.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.185 177.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.599 ' HB3' ' O ' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -87.07 -32.82 19.75 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.509 -178.657 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -67.14 -39.55 86.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.048 0.451 . . . . 0.0 111.131 176.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.499 ' HE3' ' HG3' ' A' ' 6' ' ' GLU . 16.9 ptm -74.79 -26.39 59.71 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.665 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 32.4 t80 -69.37 -36.06 76.45 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.209 173.007 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.511 ' HG2' ' O ' ' A' ' 49' ' ' LYS . 38.0 mm-40 -65.13 -31.95 73.4 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.248 0.547 . . . . 0.0 109.651 175.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -72.99 -38.6 66.59 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.99 177.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.426 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 86.1 t80 -70.02 -20.99 63.24 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.084 -177.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.686 HD22 ' HA ' ' A' ' 20' ' ' SER . 87.1 mt -81.75 -33.24 31.12 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.258 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 37.0 p -100.32 -46.45 5.26 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.9 0.381 . . . . 0.0 111.632 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.416 ' O ' ' HB2' ' A' ' 59' ' ' ARG . 6.8 t30 -89.59 -47.65 7.82 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.705 -176.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.426 ' HG2' ' O ' ' A' ' 55' ' ' TYR . 76.3 mtt180 . . . . . 0 C--O 1.251 1.151 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.231 -173.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 78.5 mtp . . . . . 0 N--CA 1.456 -0.172 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -63.03 -30.82 71.9 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.305 0.574 . . . . 0.0 110.041 177.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.605 ' O ' ' HB2' ' A' ' 9' ' ' PHE . . . -56.18 -56.45 20.72 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.691 177.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.44 ' O ' HG12 ' A' ' 10' ' ' ILE . 28.9 tt0 -71.06 -47.12 60.22 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.972 -178.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.631 ' HE2' ' O ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -42.3 -64.1 0.65 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.772 -1.104 . . . . 0.0 111.305 176.45 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.539 ' HB3' ' HD2' ' A' ' 37' ' ' ARG . 56.0 mm-40 -78.41 -16.71 57.32 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.75 -0.38 . . . . 0.0 112.009 -175.054 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.605 ' HB2' ' O ' ' A' ' 5' ' ' ALA . 21.3 t80 -69.5 -40.04 77.25 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 175.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 6' ' ' GLU . 46.0 mm -74.41 -36.31 41.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 121.551 0.691 . . . . 0.0 109.824 178.011 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 19.9 m -66.92 -33.29 75.27 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.607 178.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 18.1 ttp -76.57 -32.4 58.12 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.107 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.473 HD13 HG11 ' A' ' 18' ' ' VAL . 0.1 OUTLIER -68.43 -38.57 81.3 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.104 179.105 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 14.3 mtpt -68.18 -40.96 82.1 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.012 0.434 . . . . 0.0 110.845 175.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.437 ' CD ' HH22 ' A' ' 37' ' ' ARG . 29.8 mt-10 -67.05 -18.56 65.4 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.078 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -105.05 16.56 25.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.785 178.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 56.28 32.42 20.36 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.527 -0.761 . . . . 0.0 112.682 176.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.473 HG11 HD13 ' A' ' 13' ' ' LEU . 58.1 t -76.41 119.41 24.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.008 0.433 . . . . 0.0 111.288 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -128.58 -156.0 0.73 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.507 172.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.1 p -68.91 -8.72 46.81 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.034 0.445 . . . . 0.0 111.365 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.4 p -79.77 9.66 4.94 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.781 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.682 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 11.7 m95 -117.76 146.2 43.96 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.15 0.5 . . . . 0.0 111.876 -175.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.9 m -110.17 164.93 12.16 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 165.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.682 ' CE1' ' HB3' ' A' ' 48' ' ' LYS . 88.5 t80 -82.99 16.27 2.39 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 122.308 1.051 . . . . 0.0 110.891 -171.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.5 m -92.16 -32.55 15.06 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 113.861 -1.518 . . . . 0.0 107.947 171.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.682 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 42.5 ttt180 -71.07 -35.46 71.9 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.408 -1.269 . . . . 0.0 109.398 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.555 HG12 HD22 ' A' ' 31' ' ' LEU . 54.9 mt -64.62 -54.45 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.867 175.131 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.1 mt -62.23 -40.19 86.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 C-N-CA 119.691 -0.804 . . . . 0.0 111.348 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.6 t -76.96 -39.27 51.22 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -173.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -112.65 -33.28 6.18 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -173.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.555 HD22 HG12 ' A' ' 27' ' ' ILE . 1.6 mp -78.28 -30.27 48.41 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 122.04 -0.413 . . . . 0.0 110.859 -177.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.66 -18.61 64.04 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.731 -0.747 . . . . 0.0 111.969 175.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.0 p -112.06 -27.69 8.29 Favored 'General case' 0 C--O 1.234 0.254 0 O-C-N 122.381 -0.481 . . . . 0.0 111.996 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.9 mtm180 -74.67 -30.48 61.6 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -178.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.467 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 7.9 t70 -151.48 128.97 5.67 Favored Pre-proline 0 C--N 1.329 -0.3 0 C-N-CA 120.199 -0.6 . . . . 0.0 111.185 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 16.3 Cg_exo -69.85 -5.34 16.02 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 123.466 2.777 . . . . 0.0 113.825 -178.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.539 ' HD2' ' HB3' ' A' ' 8' ' ' GLU . 57.7 mtm180 -60.62 -22.28 63.61 Favored 'General case' 0 C--N 1.333 -0.123 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 176.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 69.1 t80 -68.3 -20.62 64.77 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.899 0.381 . . . . 0.0 110.007 176.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 56.7 m95 -105.25 -17.88 14.31 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.4 -176.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 90.5 mmm -57.65 -37.77 73.94 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.324 0.583 . . . . 0.0 109.87 175.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 6.3 p -96.62 141.3 15.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.455 -0.793 . . . . 0.0 108.886 169.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -59.92 143.7 50.85 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-O 121.616 0.722 . . . . 0.0 109.735 175.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -81.56 97.25 7.75 Favored 'General case' 0 C--N 1.301 -1.509 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.089 -171.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -102.05 98.25 9.81 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 170.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -61.41 -30.57 87.31 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.66 2.24 . . . . 0.0 112.699 -173.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.475 ' HA ' HD22 ' A' ' 46' ' ' LEU . 0.6 OUTLIER -72.53 -40.0 67.1 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.742 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . 0.484 ' O ' ' HG2' ' A' ' 51' ' ' MET . 41.8 t90 -73.79 -38.04 64.76 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-N 116.778 -0.192 . . . . 0.0 110.567 176.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.682 ' HB3' ' CE1' ' A' ' 24' ' ' PHE . 2.5 mptm? -63.37 -33.37 75.38 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.289 177.283 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.415 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 23.7 mttm -73.76 -40.6 63.37 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 120.927 0.394 . . . . 0.0 110.19 176.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 42.8 mt-10 -63.23 -44.64 94.68 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.067 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.484 ' HG2' ' O ' ' A' ' 47' ' ' TRP . 13.5 ptm -76.7 -21.61 55.08 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.215 -176.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.409 ' CZ ' HD11 ' A' ' 56' ' ' LEU . 22.5 t80 -76.35 -37.95 56.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.167 176.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 49' ' ' LYS . 37.7 mt-10 -67.56 -30.95 70.72 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 175.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.4 tttt -71.85 -37.69 70.2 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.392 175.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -66.85 -23.72 66.06 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.941 0.4 . . . . 0.0 111.039 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.409 HD11 ' CZ ' ' A' ' 52' ' ' PHE . 67.4 mt -98.6 -33.46 10.96 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.6 t -89.48 -23.32 22.12 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.05 0.453 . . . . 0.0 111.233 -177.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -126.41 -53.06 1.48 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.665 -178.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 . . . . . 0 C--O 1.251 1.164 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.585 -179.688 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 12.6 tpt . . . . . 0 N--CA 1.448 -0.549 0 CA-C-O 121.112 0.482 . . . . 0.0 109.978 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -65.11 -47.7 76.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.726 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.572 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -59.28 -43.36 92.55 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.58 -1.191 . . . . 0.0 111.265 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.721 ' HG3' ' HE3' ' A' ' 51' ' ' MET . 32.1 tt0 -63.78 -49.55 72.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.014 0.435 . . . . 0.0 110.641 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.46 ' HE2' ' HB3' ' A' ' 7' ' ' LYS . 15.1 ttpt -49.73 -51.45 38.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.362 -0.836 . . . . 0.0 112.122 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -71.32 -33.55 69.75 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.044 -179.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.637 ' O ' HD23 ' A' ' 13' ' ' LEU . 36.2 t80 -61.68 -38.17 86.83 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.133 0.492 . . . . 0.0 110.113 177.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.515 HG12 ' O ' ' A' ' 6' ' ' GLU . 44.4 mm -71.97 -35.91 55.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.349 0.595 . . . . 0.0 110.145 177.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 48.4 m -67.94 -41.5 82.45 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.642 -179.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.555 ' SD ' ' HA ' ' A' ' 9' ' ' PHE . 21.7 ptm -70.44 -28.99 65.46 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -179.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.637 HD23 ' O ' ' A' ' 9' ' ' PHE . 1.8 mm? -68.46 -37.4 80.15 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.022 177.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.412 ' HE3' ' HE1' ' A' ' 55' ' ' TYR . 12.6 mttt -69.73 -38.51 76.91 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.925 175.367 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -68.28 -27.5 66.38 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.768 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.583 ' ND2' ' HG ' ' A' ' 31' ' ' LEU . 94.3 m-20 -90.82 9.5 29.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.216 -179.151 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 57.48 31.35 20.11 Favored 'General case' 0 CA--C 1.526 0.046 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.267 176.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.605 HG21 HD13 ' A' ' 13' ' ' LEU . 66.3 t -74.1 129.45 36.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.605 -175.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -120.57 -162.58 0.95 Allowed 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 170.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.6 p -77.24 -6.45 53.11 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.899 0.38 . . . . 0.0 111.693 -178.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.5 p -81.8 -13.48 57.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.904 0.383 . . . . 0.0 111.459 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.517 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 6.1 m95 -74.2 136.02 42.78 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.704 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.8 t -90.25 156.66 18.14 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 169.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.538 ' CZ ' ' HB3' ' A' ' 48' ' ' LYS . 42.1 t80 -83.49 16.68 2.48 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 122.123 0.963 . . . . 0.0 109.513 -177.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 27.4 t -93.1 -41.7 9.8 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.135 -1.393 . . . . 0.0 107.611 171.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.517 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 54.2 ttt180 -65.25 -34.29 78.02 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.092 -1.413 . . . . 0.0 109.506 176.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.749 HG23 HD22 ' A' ' 31' ' ' LEU . 59.6 mt -62.99 -56.76 15.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.153 174.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.473 HG12 ' O ' ' A' ' 24' ' ' PHE . 40.1 mm -59.59 -38.46 75.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 120.583 -0.447 . . . . 0.0 111.644 179.125 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.8 t -82.16 -38.81 24.13 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -171.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.531 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 8.3 mm-40 -100.55 -35.26 9.58 Favored 'General case' 0 C--O 1.217 -0.657 0 C-N-CA 120.462 -0.495 . . . . 0.0 111.429 -176.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.749 HD22 HG23 ' A' ' 27' ' ' ILE . 4.6 mp -82.19 -20.14 38.42 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -177.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -79.42 -6.79 88.85 Favored Glycine 0 N--CA 1.44 -1.056 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.571 173.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 38.8 p -125.84 -29.16 3.14 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -176.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 41.5 mtt180 -56.85 -52.14 66.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.635 0.255 . . . . 0.0 111.085 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.456 ' OD1' ' HB2' ' A' ' 37' ' ' ARG . 1.8 p30 -154.93 148.96 19.04 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.297 178.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.437 ' O ' ' HG2' ' A' ' 40' ' ' MET . 20.5 Cg_exo -66.74 4.5 1.06 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.682 2.922 . . . . 0.0 114.295 -174.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.456 ' HB2' ' OD1' ' A' ' 35' ' ' ASP . 54.3 mtm180 -59.21 -34.92 72.73 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 117.77 0.259 . . . . 0.0 111.599 178.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -69.2 -17.26 63.77 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 120.899 0.38 . . . . 0.0 110.173 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -102.2 -19.25 15.16 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.725 -179.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.437 ' HG2' ' O ' ' A' ' 36' ' ' PRO . 95.7 mmm -64.11 -51.88 61.86 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 172.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.572 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 2.6 p -86.58 114.16 25.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.144 -0.934 . . . . 0.0 109.066 171.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -58.4 145.6 37.8 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 122.184 0.993 . . . . 0.0 111.709 -172.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -78.67 96.9 5.65 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 114.081 -1.418 . . . . 0.0 112.071 -170.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -104.14 99.59 17.64 Favored Pre-proline 0 C--N 1.32 -0.704 0 N-CA-C 107.551 -1.278 . . . . 0.0 107.551 165.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -62.47 -24.73 75.59 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 122.354 2.036 . . . . 0.0 113.098 -172.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.44 HD22 ' HA ' ' A' ' 46' ' ' LEU . 0.6 OUTLIER -80.62 -39.53 27.3 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 -179.19 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . 0.492 ' O ' ' HG2' ' A' ' 51' ' ' MET . 44.4 t90 -74.76 -37.83 62.37 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.403 175.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.634 ' HG3' ' CZ ' ' A' ' 9' ' ' PHE . 1.2 mptm? -61.99 -32.27 72.72 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.256 -0.275 . . . . 0.0 110.256 177.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 36.3 mttt -77.62 -39.4 45.51 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 120.841 0.353 . . . . 0.0 110.711 175.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -64.11 -40.08 95.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.037 0.446 . . . . 0.0 111.266 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.721 ' HE3' ' HG3' ' A' ' 6' ' ' GLU . 12.7 ptm -79.13 -21.33 46.7 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.558 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 22.3 t80 -69.9 -37.15 75.91 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.514 -0.551 . . . . 0.0 109.514 173.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -67.01 -30.91 71.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.133 173.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.464 ' HE2' ' OD1' ' A' ' 58' ' ' ASN . 13.7 tptm -71.72 -38.32 70.51 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.253 176.018 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.45 ' O ' ' HA ' ' A' ' 59' ' ' ARG . 32.4 t80 -65.79 -34.13 77.45 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.602 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 76.0 mt -79.24 -32.04 43.73 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 120.943 -0.303 . . . . 0.0 111.511 -179.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.1 p -87.08 -64.0 1.22 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.888 0.375 . . . . 0.0 111.692 178.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.517 ' O ' ' HB2' ' A' ' 59' ' ' ARG . 0.2 OUTLIER -70.45 -47.92 58.36 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.275 -178.214 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.517 ' HB2' ' O ' ' A' ' 58' ' ' ASN . 21.6 mmt180 . . . . . 0 C--O 1.246 0.887 0 O-C-N 123.988 0.805 . . . . 0.0 110.723 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 38.4 ttp . . . . . 0 N--CA 1.448 -0.547 0 CA-C-O 121.308 0.575 . . . . 0.0 109.515 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -62.18 -46.1 90.46 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.087 177.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.585 ' CB ' ' HB ' ' A' ' 41' ' ' VAL . . . -63.97 -29.68 70.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.979 -1.009 . . . . 0.0 111.315 -179.434 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.503 ' O ' HG12 ' A' ' 10' ' ' ILE . 12.9 tt0 -60.81 -56.62 19.09 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.417 0.627 . . . . 0.0 110.3 177.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.493 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -58.32 -42.57 87.05 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.806 -1.088 . . . . 0.0 111.374 -178.545 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -62.14 -38.59 89.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.203 0.525 . . . . 0.0 110.478 176.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.543 ' CZ ' ' HG3' ' A' ' 48' ' ' LYS . 14.6 t80 -64.84 -39.58 93.8 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.084 178.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.503 HG12 ' O ' ' A' ' 6' ' ' GLU . 48.1 mm -70.75 -37.77 70.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.138 0.494 . . . . 0.0 110.542 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 35.1 m -68.65 -31.71 71.04 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.332 176.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.486 ' SD ' ' HB3' ' A' ' 35' ' ' ASP . 37.8 ttp -71.78 -33.29 68.47 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 177.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.673 HD22 HD21 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -71.02 -39.84 72.13 Favored 'General case' 0 N--CA 1.439 -0.977 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.935 178.903 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.0 mtpp -64.67 -35.42 80.98 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.178 0.513 . . . . 0.0 110.611 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.502 ' CD ' HH22 ' A' ' 37' ' ' ARG . 29.7 mt-10 -70.63 -22.84 62.48 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.018 178.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -101.98 7.19 41.43 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.415 176.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.414 ' HB3' HE21 ' A' ' 17' ' ' GLN . 6.8 mm100 56.76 31.11 18.86 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 173.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.597 HG11 HD13 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -67.32 143.89 15.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.658 0.742 . . . . 0.0 111.274 -179.969 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.502 ' CG ' ' N ' ' A' ' 20' ' ' SER . 0.0 OUTLIER -148.25 -174.22 4.52 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.848 179.012 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.502 ' N ' ' CG ' ' A' ' 19' ' ' ASP . 4.3 p -58.02 -23.15 53.01 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 120.857 0.36 . . . . 0.0 111.754 -175.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.2 p -77.45 -1.4 30.11 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.707 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 4.3 m95 -84.94 144.96 28.0 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.927 0.394 . . . . 0.0 110.398 174.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.8 p -102.88 165.78 10.84 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 172.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.501 ' CD1' HD12 ' A' ' 27' ' ' ILE . 30.2 t80 -87.21 15.87 5.8 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 122.48 1.133 . . . . 0.0 108.553 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.2 t -91.43 -38.78 12.36 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 106.633 -1.618 . . . . 0.0 106.633 168.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.707 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 36.9 ttt180 -67.44 -34.5 77.33 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.595 176.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.737 HG23 HD23 ' A' ' 31' ' ' LEU . 52.0 mt -66.61 -42.08 89.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.644 178.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.1 mt -78.64 -33.34 16.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 C-N-CA 119.284 -0.966 . . . . 0.0 111.866 176.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.7 p -87.64 -40.58 14.06 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -171.473 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.633 ' O ' ' HD3' ' A' ' 34' ' ' ARG . 26.2 mm-40 -106.82 -36.56 6.63 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 121.279 0.561 . . . . 0.0 110.219 -176.152 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.737 HD23 HG23 ' A' ' 27' ' ' ILE . 11.5 tp -80.22 -36.17 35.19 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.322 -170.241 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.56 -22.34 76.55 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.087 175.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 35.5 p -101.57 -28.29 12.61 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 122.425 -0.456 . . . . 0.0 111.731 -178.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.633 ' HD3' ' O ' ' A' ' 30' ' ' GLU . 0.5 OUTLIER -63.34 -48.57 77.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.319 179.175 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.496 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 4.8 t70 -139.04 133.92 16.58 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-O 121.056 0.455 . . . . 0.0 111.722 -170.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.496 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 17.1 Cg_exo -68.4 -11.81 33.05 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 123.694 2.93 . . . . 0.0 113.158 -179.078 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.506 ' HA ' ' HG2' ' A' ' 40' ' ' MET . 72.2 mtm180 -62.16 -20.95 64.65 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 177.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -68.32 -21.71 64.74 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.967 0.413 . . . . 0.0 110.165 176.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.443 ' HD1' ' HA ' ' A' ' 36' ' ' PRO . 60.6 m95 -101.86 -17.74 16.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.683 -174.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.506 ' HG2' ' HA ' ' A' ' 37' ' ' ARG . 96.7 mmm -55.49 -37.16 67.46 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.234 0.54 . . . . 0.0 110.371 178.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.585 ' HB ' ' CB ' ' A' ' 5' ' ' ALA . 6.8 p -99.01 134.4 38.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 171.031 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -59.75 142.34 53.43 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-O 121.486 0.66 . . . . 0.0 109.875 177.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -78.8 98.83 6.45 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.008 -0.997 . . . . 0.0 112.547 -163.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -103.65 101.12 22.18 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 114.817 -1.083 . . . . 0.0 108.449 169.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -63.0 -26.61 73.94 Favored 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.855 2.37 . . . . 0.0 112.53 -175.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.543 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 1.1 tm? -75.75 -39.05 57.8 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . 0.482 ' O ' ' HG2' ' A' ' 51' ' ' MET . 45.4 t90 -74.53 -37.06 63.16 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.691 176.246 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.543 ' HG3' ' CZ ' ' A' ' 9' ' ' PHE . 2.3 mptm? -62.07 -32.46 73.0 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.593 -0.443 . . . . 0.0 109.978 175.452 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.559 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 26.9 mttm -72.69 -40.86 65.9 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 120.916 0.388 . . . . 0.0 110.31 174.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.543 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 26.5 mt-10 -66.15 -41.88 89.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.309 -178.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.482 ' HG2' ' O ' ' A' ' 47' ' ' TRP . 12.5 ptm -76.35 -22.05 55.36 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.86 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.503 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 28.2 t80 -75.26 -37.61 60.87 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.134 -0.484 . . . . 0.0 109.721 175.08 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.559 ' HG2' ' O ' ' A' ' 49' ' ' LYS . 79.0 mm-40 -66.35 -29.1 69.21 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 121.199 0.524 . . . . 0.0 109.634 174.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -72.53 -38.43 68.02 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.979 174.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.592 ' CE2' HG13 ' A' ' 18' ' ' VAL . 53.6 t80 -70.72 -23.08 62.38 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.621 -178.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 60.7 mt -93.54 -33.25 13.82 Favored 'General case' 0 N--CA 1.441 -0.896 0 C-N-CA 120.646 -0.422 . . . . 0.0 111.795 179.348 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 45.4 t -87.63 -32.44 19.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.8 0.333 . . . . 0.0 111.103 -178.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -109.45 -58.61 2.02 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.326 -0.397 . . . . 0.0 109.997 -178.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.8 ttm180 . . . . . 0 C--O 1.251 1.171 0 O-C-N 124.254 0.971 . . . . 0.0 110.256 -178.333 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 69.3 mtm . . . . . 0 CA--C 1.52 -0.176 0 CA-C-O 121.23 0.538 . . . . 0.0 109.737 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -65.26 -50.85 64.21 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.952 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 9' ' ' PHE . . . -61.67 -29.76 70.29 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.935 -178.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -63.14 -54.12 42.7 Favored 'General case' 0 CA--C 1.509 -0.596 0 CA-C-O 121.354 0.597 . . . . 0.0 110.0 177.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.402 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -54.87 -45.64 74.64 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.668 -1.151 . . . . 0.0 111.815 -179.263 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.54 ' O ' ' HG2' ' A' ' 12' ' ' MET . 53.2 mm-40 -68.13 -35.41 78.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.586 0.232 . . . . 0.0 111.228 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.578 ' CZ ' ' HG3' ' A' ' 48' ' ' LYS . 12.6 t80 -64.22 -38.46 91.11 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.759 177.316 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.536 HD11 ' HE3' ' A' ' 54' ' ' LYS . 24.4 mm -65.53 -37.44 80.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.572 0.701 . . . . 0.0 109.82 173.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.659 ' HA ' ' CE ' ' A' ' 14' ' ' LYS . 32.7 m -69.17 -41.39 77.29 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.546 -178.138 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.54 ' HG2' ' O ' ' A' ' 8' ' ' GLU . 15.8 ptm -73.2 -33.52 65.43 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 -179.548 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.518 HD13 HG21 ' A' ' 18' ' ' VAL . 1.7 mm? -68.51 -38.03 80.57 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.578 179.23 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.659 ' CE ' ' HA ' ' A' ' 11' ' ' THR . 0.0 OUTLIER -83.38 -24.18 32.11 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.817 -178.052 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -72.71 -34.57 67.21 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 120.996 0.426 . . . . 0.0 110.87 172.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.479 ' OD1' ' HG ' ' A' ' 31' ' ' LEU . 1.0 OUTLIER -79.3 10.16 3.96 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.987 179.953 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 55.06 31.67 16.67 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.225 177.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.518 HG21 HD13 ' A' ' 13' ' ' LEU . 53.2 t -75.17 150.14 6.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.602 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.421 ' CG ' ' H ' ' A' ' 20' ' ' SER . 6.9 t70 -168.71 -154.7 0.14 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 171.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.421 ' H ' ' CG ' ' A' ' 19' ' ' ASP . 12.3 m -59.69 -27.15 66.17 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -171.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.4 p -83.91 34.77 0.5 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.439 0.638 . . . . 0.0 111.687 -177.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.656 ' CE3' ' HB3' ' A' ' 26' ' ' ARG . 8.9 m95 -133.88 148.35 51.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.044 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 21.7 m -114.01 169.99 8.61 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 169.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.514 ' CZ ' ' HB3' ' A' ' 48' ' ' LYS . 42.6 t80 -83.89 16.75 2.65 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 122.03 0.919 . . . . 0.0 110.875 -170.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.4 m -93.29 -43.93 8.56 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.096 -1.411 . . . . 0.0 107.995 172.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.656 ' HB3' ' CE3' ' A' ' 22' ' ' TRP . 11.8 ttt180 -59.4 -36.35 75.66 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.52 176.295 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.666 HG23 HD22 ' A' ' 31' ' ' LEU . 65.7 mt -64.48 -58.78 5.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.73 177.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.2 mt -62.92 -41.31 92.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 119.898 -0.721 . . . . 0.0 111.641 -178.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.2 m -78.0 -36.91 48.29 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -175.072 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.57 ' HB2' ' O ' ' A' ' 26' ' ' ARG . 48.1 mm-40 -98.17 -36.82 9.93 Favored 'General case' 0 C--O 1.221 -0.436 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -178.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.666 HD22 HG23 ' A' ' 27' ' ' ILE . 5.3 mp -83.96 -28.44 27.78 Favored 'General case' 0 CA--C 1.508 -0.637 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.372 -171.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.19 -20.24 66.99 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.563 -0.827 . . . . 0.0 111.472 175.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.7 p -108.46 -33.79 6.96 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 178.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.48 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 39.9 mtt180 -58.89 -51.29 70.67 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 120.596 0.236 . . . . 0.0 111.141 178.16 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.474 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 6.2 t70 -139.55 129.38 14.13 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-O 121.042 0.449 . . . . 0.0 111.042 -172.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.474 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 17.1 Cg_exo -68.76 -8.29 22.95 Favored 'Trans proline' 0 CA--C 1.528 0.183 0 C-N-CA 123.539 2.826 . . . . 0.0 113.036 -178.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.63 ' HA ' ' HG3' ' A' ' 40' ' ' MET . 66.1 mtm180 -62.59 -21.57 65.72 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 178.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -66.53 -20.08 65.94 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 177.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.42 ' HD1' ' HA ' ' A' ' 36' ' ' PRO . 60.5 m95 -97.89 -18.05 18.92 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.443 -0.799 . . . . 0.0 112.082 -174.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.63 ' HG3' ' HA ' ' A' ' 37' ' ' ARG . 42.8 mtm -55.63 -49.24 73.37 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.614 0.721 . . . . 0.0 109.605 177.312 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.402 HG21 ' CZ3' ' A' ' 47' ' ' TRP . 4.2 p -99.28 122.67 51.33 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 CA-C-N 114.964 -1.017 . . . . 0.0 108.984 172.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -58.36 146.44 34.64 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-O 121.81 0.814 . . . . 0.0 111.166 -174.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.408 ' HA ' ' NZ ' ' A' ' 48' ' ' LYS . 15.1 p-10 -68.87 95.43 0.69 Allowed 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 114.349 -1.296 . . . . 0.0 112.104 -168.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -102.31 100.44 15.59 Favored Pre-proline 0 N--CA 1.444 -0.738 0 CA-C-N 114.367 -1.288 . . . . 0.0 107.752 169.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -60.81 -29.69 88.71 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 122.209 1.939 . . . . 0.0 112.325 -173.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 2.6 tm? -73.37 -39.94 64.75 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -178.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . 0.402 ' CZ3' HG21 ' A' ' 41' ' ' VAL . 42.3 t90 -77.77 -37.56 48.73 Favored 'General case' 0 C--O 1.222 -0.343 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.611 177.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.578 ' HG3' ' CZ ' ' A' ' 9' ' ' PHE . 1.4 mptm? -62.38 -31.73 72.44 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 177.26 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.4 mttt -77.92 -40.12 40.67 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.69 0.281 . . . . 0.0 111.019 175.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.468 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 27.0 mt-10 -61.86 -46.1 90.9 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.441 0.639 . . . . 0.0 110.664 179.17 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.478 ' SD ' ' CD1' ' A' ' 9' ' ' PHE . 0.7 OUTLIER -71.85 -33.37 68.38 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.712 -177.927 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.458 ' CZ ' HD11 ' A' ' 56' ' ' LEU . 26.1 t80 -70.44 -38.3 74.49 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.513 -178.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 50' ' ' GLU . 11.6 pt-20 -72.28 -22.93 61.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.4 0.619 . . . . 0.0 109.818 178.233 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.697 ' HG2' ' HB2' ' A' ' 58' ' ' ASN . 2.7 tmmm? -72.5 -37.15 68.49 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.278 171.051 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.633 ' OH ' ' HA ' ' A' ' 14' ' ' LYS . 54.9 t80 -66.44 -21.95 66.21 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.961 0.41 . . . . 0.0 110.318 176.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.458 HD11 ' CZ ' ' A' ' 52' ' ' PHE . 60.8 mt -95.37 -35.33 11.8 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 178.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 44.0 t -88.57 -55.43 3.72 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.12 0.486 . . . . 0.0 110.579 -178.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.697 ' HB2' ' HG2' ' A' ' 54' ' ' LYS . 5.6 m120 -77.02 -51.62 10.77 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.348 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.429 HH11 ' HD2' ' A' ' 59' ' ' ARG . 48.7 mtt180 . . . . . 0 C--O 1.248 0.992 0 O-C-N 123.936 0.773 . . . . 0.0 110.629 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.674 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -91.15 59.53 4.01 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.162 0.506 . . . . 0.0 110.726 -178.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.411 ' HB2' ' OE1' ' A' ' 4' ' ' GLU . 69.5 mtm -113.14 -81.21 0.59 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.461 178.443 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.411 ' OE1' ' HB2' ' A' ' 3' ' ' MET . 1.8 mp0 -61.25 -46.52 90.05 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.5 0.667 . . . . 0.0 110.522 -178.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.536 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -59.33 -47.36 85.71 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 114.479 -1.237 . . . . 0.0 111.577 -179.295 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -63.33 -47.18 83.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.997 0.427 . . . . 0.0 110.895 -178.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -52.31 -54.22 34.24 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.066 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -64.72 -36.46 84.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.273 178.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.629 ' O ' HD23 ' A' ' 13' ' ' LEU . 24.9 t80 -61.41 -37.78 84.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.373 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.7 mm -68.71 -38.65 79.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.131 0.491 . . . . 0.0 110.264 177.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.8 m -69.53 -41.67 75.68 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.573 -177.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.509 ' SD ' ' HA ' ' A' ' 9' ' ' PHE . 24.1 ptm -69.11 -26.81 65.1 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 -179.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.629 HD23 ' O ' ' A' ' 9' ' ' PHE . 1.3 mm? -69.27 -38.31 78.31 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.36 179.038 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -70.89 -42.33 70.13 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.03 0.443 . . . . 0.0 110.531 174.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -69.34 -28.89 66.62 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.169 -176.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.412 HD22 ' N ' ' A' ' 16' ' ' ASN . 0.9 OUTLIER -85.81 8.65 19.2 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.929 0.395 . . . . 0.0 110.09 175.473 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 59.61 32.5 21.6 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 115.265 -0.879 . . . . 0.0 112.616 175.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.514 HG21 HD13 ' A' ' 13' ' ' LEU . 41.5 t -77.43 141.72 15.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.949 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -154.01 -159.71 1.01 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.95 172.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.705 ' HA ' HD22 ' A' ' 56' ' ' LEU . 16.9 m -60.25 -27.01 66.89 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -176.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 41.5 p -85.3 45.91 1.23 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 121.181 0.515 . . . . 0.0 111.563 -178.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.583 ' CE2' ' HD3' ' A' ' 26' ' ' ARG . 5.5 m95 -139.61 146.82 40.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.607 -177.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 93.7 p -105.12 170.22 8.0 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 170.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.445 ' CE1' ' HB3' ' A' ' 48' ' ' LYS . 61.4 t80 -85.2 15.37 4.28 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 122.133 0.968 . . . . 0.0 109.454 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.9 t -92.75 -41.02 10.36 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 113.859 -1.519 . . . . 0.0 107.335 172.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.583 ' HD3' ' CE2' ' A' ' 22' ' ' TRP . 18.1 ttt180 -65.74 -32.86 74.63 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 114.327 -1.306 . . . . 0.0 109.635 177.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.7 HG23 HD22 ' A' ' 31' ' ' LEU . 33.4 mt -63.08 -54.46 33.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.198 174.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.5 mt -62.37 -32.71 55.9 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 120.411 -0.515 . . . . 0.0 111.893 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 96.9 p -85.51 -37.89 19.17 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -174.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.479 ' HB3' ' HE ' ' A' ' 34' ' ' ARG . 40.0 mm-40 -101.56 -35.75 9.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.902 0.382 . . . . 0.0 111.497 -174.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.7 HD22 HG23 ' A' ' 27' ' ' ILE . 5.3 mp -86.43 -16.33 37.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.388 0.613 . . . . 0.0 109.662 -174.432 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -81.05 -3.79 90.62 Favored Glycine 0 N--CA 1.442 -0.933 0 CA-C-N 115.199 -0.909 . . . . 0.0 111.904 177.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 41.3 p -129.04 -38.25 1.64 Allowed 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -176.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.479 ' HE ' ' HB3' ' A' ' 30' ' ' GLU . 89.9 mtt-85 -54.84 -45.63 74.53 Favored 'General case' 0 C--O 1.232 0.174 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -176.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.461 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 2.8 p30 -155.92 138.95 10.75 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 172.429 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.497 ' O ' ' HG3' ' A' ' 40' ' ' MET . 16.7 Cg_exo -68.98 14.45 0.2 Allowed 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 123.457 2.771 . . . . 0.0 114.474 -171.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 43.3 mtm180 -63.35 -28.72 70.19 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 122.128 -0.357 . . . . 0.0 111.043 177.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -68.02 -17.44 64.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.387 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 56.2 m95 -106.95 -24.37 12.04 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.921 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.497 ' HG3' ' O ' ' A' ' 36' ' ' PRO . 89.2 mtp -56.14 -49.89 72.67 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 174.185 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.536 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 2.9 p -86.25 123.37 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.354 -0.839 . . . . 0.0 108.77 169.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -58.58 144.32 43.22 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-O 121.729 0.776 . . . . 0.0 111.275 -174.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -73.12 97.32 2.35 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 114.726 -1.124 . . . . 0.0 111.987 -171.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -103.05 97.98 10.76 Favored Pre-proline 0 C--N 1.318 -0.766 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 164.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.687 ' O ' ' HB3' ' A' ' 49' ' ' LYS . 17.3 Cg_exo -66.74 -22.21 50.23 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.302 2.001 . . . . 0.0 112.417 -172.51 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.414 HD22 ' HA ' ' A' ' 46' ' ' LEU . 0.3 OUTLIER -82.3 -37.82 25.24 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 179.586 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 45.4 t90 -74.68 -38.75 62.32 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.54 175.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.599 ' HG3' ' CZ ' ' A' ' 9' ' ' PHE . 1.4 mptm? -61.18 -32.41 72.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.035 0.445 . . . . 0.0 110.138 176.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.687 ' HB3' ' O ' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -88.59 -33.07 17.8 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.763 -176.493 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -62.9 -47.94 81.12 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.378 0.608 . . . . 0.0 110.257 171.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 1.5 ppp? -71.63 -24.12 61.81 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.032 -176.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.55 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 20.3 t80 -69.25 -36.45 77.16 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.095 174.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -65.9 -28.22 68.78 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.184 0.516 . . . . 0.0 109.943 174.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 10.1 tttm -72.58 -37.15 68.26 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.408 172.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.493 ' HA ' ' HA ' ' A' ' 59' ' ' ARG . 63.5 t80 -72.39 -18.8 61.7 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.125 0.488 . . . . 0.0 110.983 -179.114 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.705 HD22 ' HA ' ' A' ' 20' ' ' SER . 72.9 mt -92.28 -32.63 14.95 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 120.839 0.352 . . . . 0.0 111.073 176.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.3 t -85.68 -48.99 8.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.964 0.411 . . . . 0.0 110.754 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -102.6 -45.24 5.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.904 -179.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.493 ' HA ' ' HA ' ' A' ' 55' ' ' TYR . 40.3 ttm180 . . . . . 0 C--O 1.249 1.03 0 CA-C-O 117.957 -1.021 . . . . 0.0 110.733 178.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.689 0 N-CA-C 111.71 -0.556 . . . . 0.0 111.71 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.767 ' HB1' ' HB3' ' A' ' 5' ' ' ALA . . . -87.69 74.53 9.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.019 0.438 . . . . 0.0 110.206 -178.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.54 ' O ' ' HG3' ' A' ' 7' ' ' LYS . 26.6 mmt -72.25 -62.5 1.41 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.248 -172.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -68.76 -31.69 70.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.003 0.43 . . . . 0.0 109.963 -178.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.767 ' HB3' ' HB1' ' A' ' 2' ' ' ALA . . . -61.65 -44.47 96.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.723 176.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -61.45 -47.32 86.24 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 121.076 0.465 . . . . 0.0 110.466 175.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.54 ' HG3' ' O ' ' A' ' 3' ' ' MET . 48.9 mtpt -55.96 -49.48 73.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.405 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -65.04 -31.16 72.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.851 0.358 . . . . 0.0 110.949 178.083 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.48 ' HE2' ' HE2' ' A' ' 48' ' ' LYS . 1.4 t80 -69.84 -40.21 75.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.94 -179.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.5 mm -73.5 -37.16 49.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.185 0.517 . . . . 0.0 110.144 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 26.8 m -65.56 -31.97 73.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.402 176.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 24.0 ttp -75.06 -33.91 61.76 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 115.322 -0.853 . . . . 0.0 108.944 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.487 HD13 HG11 ' A' ' 18' ' ' VAL . 0.2 OUTLIER -68.85 -38.88 80.07 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.835 -179.017 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.4 mppt? -73.89 -32.55 63.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.871 0.367 . . . . 0.0 110.904 177.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -69.2 -20.62 63.98 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.585 176.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.408 ' OD1' ' HD3' ' A' ' 34' ' ' ARG . 39.0 m-80 -106.65 17.48 23.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.657 -0.247 . . . . 0.0 111.471 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.1 mm100 53.6 30.98 11.69 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.592 175.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.487 HG11 HD13 ' A' ' 13' ' ' LEU . 58.7 t -68.5 136.84 25.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.742 -177.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -148.62 -156.37 0.71 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.8 p -74.37 -15.07 60.94 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.003 -176.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.3 t -83.13 -3.45 57.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.412 0.625 . . . . 0.0 110.739 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.56 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 6.0 m95 -92.18 128.32 37.99 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.112 176.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 70.8 p -95.71 174.63 6.88 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.49 -0.929 . . . . 0.0 108.49 170.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.529 ' CD1' HD12 ' A' ' 27' ' ' ILE . 27.8 t80 -86.5 15.18 5.74 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.132 178.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.8 t -93.23 -33.14 14.09 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 113.897 -1.501 . . . . 0.0 107.211 171.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.56 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 31.6 ttt180 -72.58 -33.71 66.94 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.285 176.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.574 HG23 HD23 ' A' ' 31' ' ' LEU . 45.8 mt -65.12 -39.13 84.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.509 176.048 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 72.8 mt -76.27 -44.0 36.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 C-N-CA 119.594 -0.842 . . . . 0.0 111.572 173.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 99.0 p -74.38 -38.07 63.26 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -171.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.543 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 50.2 mm-40 -109.96 -37.64 5.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.224 0.535 . . . . 0.0 111.226 -177.08 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.574 HD23 HG23 ' A' ' 27' ' ' ILE . 11.6 tp -87.84 -12.78 43.91 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.857 -162.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -83.28 -15.68 71.13 Favored Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.47 -0.872 . . . . 0.0 111.719 176.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.4 p -120.28 -26.96 5.34 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.543 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 46.5 mtt180 -57.12 -40.01 76.23 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.618 0.247 . . . . 0.0 111.104 178.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.494 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 8.8 t70 -152.58 129.89 5.79 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.412 179.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.494 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 22.3 Cg_exo -66.37 -0.89 4.74 Favored 'Trans proline' 0 CA--C 1.531 0.357 0 C-N-CA 123.658 2.905 . . . . 0.0 113.824 -177.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.449 ' HE ' ' CG ' ' A' ' 35' ' ' ASP . 68.2 mtm180 -61.36 -21.27 63.88 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 175.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -68.07 -18.67 64.74 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.221 0.534 . . . . 0.0 109.795 175.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 53.5 m95 -104.35 -17.29 14.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.409 -176.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 32.6 tpp -60.84 -38.55 85.86 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 121.243 0.544 . . . . 0.0 109.564 176.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.655 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 7.2 p -93.61 139.36 18.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.123 171.355 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -64.6 145.69 55.79 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-O 121.727 0.775 . . . . 0.0 111.778 -176.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -68.39 96.68 0.69 Allowed 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.155 -1.384 . . . . 0.0 112.051 -171.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.506 ' O ' ' HD3' ' A' ' 48' ' ' LYS . 9.8 t70 -122.24 98.31 44.43 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 114.877 -1.056 . . . . 0.0 108.623 169.074 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -60.52 -32.49 93.65 Favored 'Trans proline' 0 CA--C 1.516 -0.409 0 C-N-CA 122.937 2.425 . . . . 0.0 112.758 -174.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.68 -38.35 58.77 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.952 -178.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . 0.542 ' CZ3' HG21 ' A' ' 41' ' ' VAL . 71.2 t90 -73.2 -36.6 66.55 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.896 -0.321 . . . . 0.0 110.147 174.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.506 ' HD3' ' O ' ' A' ' 44' ' ' ASP . 2.3 mptm? -61.07 -34.1 74.37 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.717 -0.393 . . . . 0.0 109.944 176.227 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.486 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 33.3 mttt -78.72 -40.66 32.97 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 120.875 0.369 . . . . 0.0 110.59 178.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -65.96 -43.41 88.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.414 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 2.8 ppp? -73.28 -29.02 62.44 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 -178.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -69.79 -37.95 76.51 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.423 176.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.486 ' HG3' ' O ' ' A' ' 49' ' ' LYS . 92.5 mt-10 -69.6 -26.5 64.48 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 175.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 40.8 tptt -72.98 -37.52 67.0 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.224 0.535 . . . . 0.0 109.618 174.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.439 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 80.1 t80 -63.18 -30.4 71.55 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.684 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 64.6 mt -89.97 -32.83 16.62 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.408 179.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.4 t -79.79 -48.71 13.13 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.878 0.37 . . . . 0.0 111.466 -178.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -100.79 -45.76 5.36 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.547 -176.106 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 55' ' ' TYR . 3.1 mmt180 . . . . . 0 C--O 1.249 1.066 0 O-C-N 123.89 0.744 . . . . 0.0 110.751 176.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.51 0 N-CA-C 111.942 -0.463 . . . . 0.0 111.942 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 58.05 28.95 17.05 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 123.409 0.683 . . . . 0.0 112.089 178.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 68.8 mtm -83.25 -54.05 5.3 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 121.067 -0.253 . . . . 0.0 110.886 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -57.07 -42.98 81.64 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.402 0.62 . . . . 0.0 109.934 175.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.603 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -60.43 -47.29 86.75 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 114.746 -1.115 . . . . 0.0 111.129 178.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -59.15 -49.71 76.84 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.107 0.479 . . . . 0.0 110.395 178.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.403 ' HD2' ' HA ' ' A' ' 7' ' ' LYS . 12.9 mmmm -54.54 -44.85 73.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.945 -179.262 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.453 ' HB3' ' HD3' ' A' ' 37' ' ' ARG . 40.9 mt-10 -75.88 -25.53 56.22 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.036 179.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -72.31 -39.9 67.9 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.828 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.624 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 39.2 mm -68.57 -38.73 79.52 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.222 0 CA-C-O 121.389 0.614 . . . . 0.0 109.939 177.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.0 m -67.62 -29.68 69.06 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.049 176.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 42.7 ttp -77.24 -29.43 54.07 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.334 -178.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.537 HD13 HG11 ' A' ' 18' ' ' VAL . 0.2 OUTLIER -71.21 -38.58 72.03 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.733 179.367 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.624 ' HD3' ' O ' ' A' ' 10' ' ' ILE . 0.3 OUTLIER -74.38 -31.89 62.54 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.691 176.775 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -63.43 -32.09 73.43 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.354 175.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -98.15 10.28 40.9 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.485 -177.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 55.4 mm-40 58.11 31.92 21.34 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.911 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.537 HG11 HD13 ' A' ' 13' ' ' LEU . 65.1 t -69.92 123.31 23.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.617 -176.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -142.07 -159.45 0.97 Allowed 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 170.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.5 t -59.02 -17.32 24.09 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -176.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.2 t -77.67 -3.78 42.79 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 122.133 -0.354 . . . . 0.0 111.414 178.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.522 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 7.8 m95 -99.43 138.1 37.0 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.234 176.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 87.7 p -110.5 178.91 4.23 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 170.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.536 ' CD1' HD12 ' A' ' 27' ' ' ILE . 15.9 t80 -86.14 16.69 4.1 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.999 0.904 . . . . 0.0 109.272 178.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.7 t -93.48 -38.18 11.55 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 169.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.522 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 29.3 ttt180 -71.56 -33.32 69.01 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 114.049 -1.432 . . . . 0.0 109.166 177.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.571 HG12 HD22 ' A' ' 31' ' ' LEU . 29.3 mt -64.92 -50.24 75.97 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.391 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.121 173.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 24' ' ' PHE . 44.6 mm -62.59 -43.19 98.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 119.822 -0.751 . . . . 0.0 111.198 177.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 48.4 t -70.58 -38.59 74.08 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -176.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.507 ' HB3' ' HE ' ' A' ' 34' ' ' ARG . 20.4 mm-40 -113.83 -34.95 5.29 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -171.196 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.571 HD22 HG12 ' A' ' 27' ' ' ILE . 0.5 OUTLIER -87.65 -26.36 23.06 Favored 'General case' 0 C--N 1.319 -0.754 0 O-C-N 121.771 -0.581 . . . . 0.0 111.01 -175.106 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -86.1 9.19 70.5 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.707 -0.759 . . . . 0.0 111.518 175.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 46.0 p -132.02 -54.0 0.98 Allowed 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -177.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.507 ' HE ' ' HB3' ' A' ' 30' ' ' GLU . 65.9 mtt-85 -52.87 -46.06 67.74 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -177.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.503 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 9.3 t70 -139.21 132.84 15.86 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.999 -171.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.503 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 17.3 Cg_exo -68.29 -2.21 8.6 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 123.32 2.68 . . . . 0.0 113.35 -178.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.474 ' HE ' ' CG ' ' A' ' 35' ' ' ASP . 48.0 mtm180 -56.13 -30.32 61.96 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 176.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.403 ' CE1' ' HD2' ' A' ' 48' ' ' LYS . 67.7 t80 -69.5 -21.76 63.65 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.767 0.318 . . . . 0.0 110.393 178.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 62.6 m95 -104.08 -19.98 13.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.93 -174.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.455 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 38.2 mtm -60.8 -39.64 89.66 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.474 0.654 . . . . 0.0 109.559 177.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.603 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 5.2 p -88.38 130.65 37.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.102 -0.953 . . . . 0.0 108.664 169.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.23 136.74 58.05 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-O 121.447 0.642 . . . . 0.0 109.637 178.061 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.407 ' O ' ' HD3' ' A' ' 45' ' ' PRO . 29.5 t70 -75.88 96.47 3.72 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 114.882 -1.053 . . . . 0.0 112.091 -166.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -100.84 95.91 5.02 Favored Pre-proline 0 C--N 1.321 -0.643 0 N-CA-C 107.113 -1.439 . . . . 0.0 107.113 165.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.661 ' HA ' ' HB2' ' A' ' 48' ' ' LYS . 19.4 Cg_exo -67.11 -23.56 45.8 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 122.421 2.08 . . . . 0.0 112.107 -171.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -71.24 -38.32 71.95 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 56.4 t90 -75.72 -38.27 58.7 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 172.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.661 ' HB2' ' HA ' ' A' ' 45' ' ' PRO . 27.0 mmtp -61.01 -35.81 77.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.328 179.171 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.531 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 43.8 mttt -80.38 -40.29 26.81 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.669 179.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -66.14 -37.95 86.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.321 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 1.3 ppp? -71.73 -32.85 68.18 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.497 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 35.6 t80 -71.01 -37.96 72.65 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.665 176.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.531 ' HG2' ' O ' ' A' ' 49' ' ' LYS . 24.2 mm-40 -66.51 -30.84 71.25 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 175.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -72.45 -37.96 68.4 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.2 178.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.685 ' HA ' ' HA ' ' A' ' 59' ' ' ARG . 75.7 t80 -70.98 -24.51 62.41 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.75 -177.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 82.8 mt -87.95 -34.02 18.24 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.791 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.6 p -86.35 -41.11 14.79 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.952 0.406 . . . . 0.0 111.407 -178.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -118.13 -42.17 2.82 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.163 -176.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.685 ' HA ' ' HA ' ' A' ' 55' ' ' TYR . 39.0 ttm180 . . . . . 0 C--O 1.247 0.943 0 CA-C-O 118.123 -0.942 . . . . 0.0 110.378 -177.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.701 0 N-CA-C 111.978 -0.449 . . . . 0.0 111.978 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 58.42 24.15 11.43 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 176.047 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.489 ' O ' ' HG2' ' A' ' 7' ' ' LYS . 34.4 mmt -87.33 -46.13 9.96 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 122.249 -0.282 . . . . 0.0 110.336 -178.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -68.15 -35.0 77.36 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 176.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.501 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -64.25 -41.21 97.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.388 175.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.512 ' O ' HG12 ' A' ' 10' ' ' ILE . 29.8 tt0 -57.39 -47.03 82.74 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.038 176.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.565 ' HE2' ' N ' ' A' ' 7' ' ' LYS . 9.4 mmpt? -52.5 -52.35 54.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.446 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -62.78 -39.02 92.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.551 178.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.525 ' CE2' ' HG3' ' A' ' 48' ' ' LYS . 16.2 t80 -63.11 -39.48 94.81 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.465 -178.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.595 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 47.4 mm -74.31 -37.11 44.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.183 0.516 . . . . 0.0 110.226 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 29.9 m -64.11 -34.82 78.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.597 0.713 . . . . 0.0 110.289 176.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 33.4 ttp -75.93 -30.68 58.8 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.281 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.452 HD13 HG11 ' A' ' 18' ' ' VAL . 0.1 OUTLIER -70.36 -38.41 74.77 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.042 179.128 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.595 ' HD3' ' O ' ' A' ' 10' ' ' ILE . 0.0 OUTLIER -72.18 -33.48 67.7 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.756 0.313 . . . . 0.0 110.485 176.258 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -66.19 -26.76 67.55 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 121.288 0.566 . . . . 0.0 111.511 176.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 -102.02 14.57 31.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.785 -177.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 53.95 31.42 13.39 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.849 175.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.452 HG11 HD13 ' A' ' 13' ' ' LEU . 66.4 t -67.12 136.06 27.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.245 0.545 . . . . 0.0 111.634 -173.082 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -157.94 -160.21 0.89 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.349 175.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 p -55.51 -24.39 31.47 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 123.383 0.427 . . . . 0.0 112.098 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.6 p -69.96 -11.17 60.67 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 120.972 0.415 . . . . 0.0 112.0 -179.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.579 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 11.5 m95 -95.75 133.83 39.39 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.169 0.509 . . . . 0.0 110.969 179.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 m -105.86 168.54 9.05 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 168.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.583 ' CD1' HD12 ' A' ' 27' ' ' ILE . 18.9 t80 -82.5 15.78 2.39 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 122.087 0.946 . . . . 0.0 109.912 -176.261 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.6 t -92.84 -34.3 13.89 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.173 -1.376 . . . . 0.0 107.674 170.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.579 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 40.8 ttt180 -70.14 -36.14 74.56 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.618 -1.174 . . . . 0.0 108.99 178.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.61 HG23 HD23 ' A' ' 31' ' ' LEU . 52.4 mt -64.77 -47.14 89.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.334 176.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.6 mt -70.51 -42.79 78.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 C-N-CA 119.546 -0.861 . . . . 0.0 111.705 177.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.3 t -77.55 -39.02 47.35 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -171.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 22.9 mm-40 -111.52 -35.39 5.81 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 121.077 0.465 . . . . 0.0 111.345 -174.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.61 HD23 HG23 ' A' ' 27' ' ' ILE . 11.4 tp -84.87 -36.67 21.39 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.478 -168.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -68.07 -17.42 69.83 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.763 174.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 65.1 p -107.1 -1.9 21.54 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 122.452 -0.44 . . . . 0.0 111.564 -178.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 60.3 mtt-85 -88.99 -47.37 8.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.542 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.495 ' OD1' ' HG3' ' A' ' 37' ' ' ARG . 11.8 t70 -149.32 137.41 11.71 Favored Pre-proline 0 C--N 1.325 -0.469 0 C-N-CA 120.904 -0.319 . . . . 0.0 111.222 -172.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.521 ' HA ' ' HD1' ' A' ' 39' ' ' TRP . 34.2 Cg_exo -63.32 -7.02 11.15 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.681 2.92 . . . . 0.0 113.959 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.495 ' HG3' ' OD1' ' A' ' 35' ' ' ASP . 47.0 mtm180 -56.41 -28.79 60.4 Favored 'General case' 0 CA--C 1.529 0.146 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 174.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -71.96 -20.27 61.76 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.816 0.341 . . . . 0.0 110.686 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.521 ' HD1' ' HA ' ' A' ' 36' ' ' PRO . 56.7 m95 -106.81 -23.53 12.36 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.436 -175.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 39.3 ttm -51.91 -47.3 64.68 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 121.36 0.6 . . . . 0.0 109.951 175.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.501 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 2.5 p -87.43 116.67 30.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 167.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -58.19 145.42 37.23 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 121.464 0.649 . . . . 0.0 110.98 -173.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -63.33 98.09 0.15 Allowed 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.25 -1.341 . . . . 0.0 113.909 -164.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -111.11 95.94 27.65 Favored Pre-proline 0 N--CA 1.426 -1.628 0 CA-C-N 113.121 -1.854 . . . . 0.0 108.97 166.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_exo -67.71 -32.87 29.28 Favored 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 122.663 2.242 . . . . 0.0 112.662 -173.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.681 ' HA ' ' HE3' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -70.63 -36.39 73.44 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.881 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . 0.496 ' O ' ' HG2' ' A' ' 51' ' ' MET . 39.6 t90 -74.2 -39.27 63.26 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 119.608 -0.837 . . . . 0.0 110.111 175.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.525 ' HG3' ' CE2' ' A' ' 9' ' ' PHE . 0.0 OUTLIER -63.83 -32.77 74.39 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 176.312 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.681 ' HE3' ' HA ' ' A' ' 46' ' ' LEU . 12.0 ptpt -78.72 -38.59 38.62 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.136 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -68.52 -42.03 79.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.642 179.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.496 ' HG2' ' O ' ' A' ' 47' ' ' TRP . 15.6 ptm -74.22 -26.65 60.38 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.54 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 39.8 t80 -70.33 -37.15 74.63 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-N 115.938 -0.573 . . . . 0.0 109.605 175.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -66.57 -30.85 71.25 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.941 175.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -72.85 -37.39 67.43 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-O 121.353 0.597 . . . . 0.0 109.904 177.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.437 ' HE2' ' O ' ' A' ' 18' ' ' VAL . 75.1 t80 -71.49 -24.71 62.03 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.643 -178.094 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 40.2 mt -93.7 -33.47 13.63 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.369 178.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 21.2 t -100.06 25.06 7.8 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.36 0.6 . . . . 0.0 110.664 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -171.11 -66.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.051 177.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.426 ' HB2' ' O ' ' A' ' 55' ' ' TYR . 36.6 ttm180 . . . . . 0 C--O 1.249 1.038 0 O-C-N 124.333 1.02 . . . . 0.0 109.543 -172.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.703 0 N-CA-C 111.967 -0.453 . . . . 0.0 111.967 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 63.23 26.49 15.21 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 122.956 0.502 . . . . 0.0 111.343 178.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 18.6 ttt -67.5 -50.77 57.43 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 121.583 0.706 . . . . 0.0 110.007 179.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -62.7 -44.04 97.26 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.028 178.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.674 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -60.31 -45.03 94.81 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.24 177.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.452 ' O ' HG12 ' A' ' 10' ' ' ILE . 29.2 tt0 -57.34 -54.39 47.38 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 121.131 0.491 . . . . 0.0 110.254 177.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.1 ttpt -50.15 -50.35 49.19 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.009 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -61.09 -40.18 92.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.046 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.62 ' CZ ' ' HG3' ' A' ' 48' ' ' LYS . 25.4 t80 -67.38 -40.1 85.68 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.91 -177.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.453 HG22 ' HE3' ' A' ' 14' ' ' LYS . 40.1 mm -74.88 -36.34 38.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.28 0.562 . . . . 0.0 110.284 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.4 m -71.38 -28.11 63.8 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.406 177.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.482 ' SD ' ' HB3' ' A' ' 35' ' ' ASP . 27.2 ttp -74.47 -34.6 63.16 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 177.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.437 HD13 HG11 ' A' ' 18' ' ' VAL . 0.1 OUTLIER -68.59 -38.03 80.31 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.04 178.396 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.453 ' HE3' HG22 ' A' ' 10' ' ' ILE . 33.6 mttt -68.81 -43.15 76.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.205 0.526 . . . . 0.0 111.04 176.504 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -66.08 -29.64 70.01 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.025 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -91.68 11.19 25.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.657 0.265 . . . . 0.0 111.087 177.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 55.29 31.84 17.43 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.535 176.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.437 HG11 HD13 ' A' ' 13' ' ' LEU . 58.7 t -65.73 130.04 30.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.405 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -140.87 -164.15 1.68 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.429 176.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.2 p -56.21 -28.31 57.85 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -178.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 79.6 p -75.39 -6.77 51.7 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.027 0.441 . . . . 0.0 111.999 -176.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.747 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 9.8 m95 -89.38 126.08 35.4 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.112 0.482 . . . . 0.0 111.442 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.433 ' C ' ' H ' ' A' ' 25' ' ' SER . 30.4 t -83.89 155.65 22.79 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 167.54 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.576 ' CZ ' ' HB3' ' A' ' 48' ' ' LYS . 91.0 t80 -81.0 15.35 1.87 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-O 122.709 1.242 . . . . 0.0 109.356 -179.026 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.433 ' H ' ' C ' ' A' ' 23' ' ' SER . 15.1 t -92.28 -30.72 15.71 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 113.136 -1.847 . . . . 0.0 107.366 171.342 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.747 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 62.7 ttt180 -73.49 -37.63 65.66 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 114.478 -1.237 . . . . 0.0 109.59 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.55 ' O ' ' HB2' ' A' ' 31' ' ' LEU . 64.5 mt -63.12 -52.33 60.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.615 175.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 76.6 mt -61.11 -42.16 92.15 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 120.069 -0.652 . . . . 0.0 111.27 178.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.2 t -77.97 -39.13 43.51 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -172.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.578 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 12.8 mt-10 -107.33 -37.07 6.34 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.973 -0.691 . . . . 0.0 111.993 -176.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.55 ' HB2' ' O ' ' A' ' 27' ' ' ILE . 1.2 mp -78.13 -31.11 49.69 Favored 'General case' 0 C--N 1.323 -0.566 0 O-C-N 122.025 -0.422 . . . . 0.0 111.315 -172.034 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.11 -32.84 67.82 Favored Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.546 176.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.7 t -104.32 -19.39 14.1 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -178.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.578 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 62.2 mtt-85 -74.63 -34.39 62.77 Favored 'General case' 0 CA--C 1.517 -0.302 0 O-C-N 122.316 -0.24 . . . . 0.0 111.628 179.216 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.482 ' HB3' ' SD ' ' A' ' 12' ' ' MET . 8.7 t0 -147.76 129.78 7.53 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-O 120.994 0.426 . . . . 0.0 111.087 -175.397 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 16.9 Cg_exo -68.71 -6.0 16.81 Favored 'Trans proline' 0 CA--C 1.529 0.251 0 C-N-CA 123.363 2.708 . . . . 0.0 112.795 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.548 ' HA ' ' HG2' ' A' ' 40' ' ' MET . 51.9 mtt180 -61.69 -25.08 67.18 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.625 0.231 . . . . 0.0 111.625 176.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -68.13 -21.64 64.92 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 176.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 48.6 m95 -99.36 -17.13 18.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.485 -177.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.548 ' HG2' ' HA ' ' A' ' 37' ' ' ARG . 86.2 mmm -49.61 -38.62 32.52 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.317 0.579 . . . . 0.0 110.564 175.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.674 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 3.5 p -113.07 129.95 67.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.084 173.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.45 143.12 50.8 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-O 121.45 0.643 . . . . 0.0 109.714 177.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.464 ' O ' ' HD3' ' A' ' 45' ' ' PRO . 25.6 t0 -76.79 99.31 5.09 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.05 -0.977 . . . . 0.0 113.153 -160.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -96.22 99.26 5.01 Favored Pre-proline 0 C--N 1.324 -0.536 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 166.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.464 ' HD3' ' O ' ' A' ' 43' ' ' ASP . 37.6 Cg_exo -62.38 -30.32 80.48 Favored 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 122.934 2.423 . . . . 0.0 112.765 -174.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.461 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 1.1 tm? -71.18 -39.03 72.1 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.219 -0.659 . . . . 0.0 109.219 -179.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . 0.455 ' O ' ' HG2' ' A' ' 51' ' ' MET . 42.5 t90 -75.2 -38.53 60.7 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.454 176.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.62 ' HG3' ' CZ ' ' A' ' 9' ' ' PHE . 2.1 mptm? -62.83 -33.99 76.39 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.628 177.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.426 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 33.4 mttt -75.37 -38.75 59.83 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.477 176.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.461 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 32.3 mt-10 -62.37 -47.48 84.0 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.264 177.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.455 ' HG2' ' O ' ' A' ' 47' ' ' TRP . 13.5 ptm -73.13 -22.74 60.47 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.098 -176.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.505 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 24.0 t80 -76.97 -38.43 53.26 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.53 176.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 49' ' ' LYS . 47.2 mm-40 -67.31 -33.83 76.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.924 0.393 . . . . 0.0 110.019 176.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.2 tttt -72.32 -37.73 68.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.866 175.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -61.85 -31.75 72.04 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.52 178.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 83.1 mt -84.15 -33.28 24.29 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -178.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 72.4 p -106.26 9.16 32.13 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -175.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.48 ' O ' ' HB2' ' A' ' 59' ' ' ARG . 0.2 OUTLIER -153.09 -49.79 0.1 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.741 -0.209 . . . . 0.0 110.498 -176.759 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.48 ' HB2' ' O ' ' A' ' 58' ' ' ASN . 50.9 mtt180 . . . . . 0 C--O 1.247 0.931 0 O-C-N 124.113 0.883 . . . . 0.0 110.168 -178.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.738 0 N-CA-C 112.104 -0.398 . . . . 0.0 112.104 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -86.84 22.25 2.03 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.85 0.357 . . . . 0.0 111.429 -175.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.427 ' O ' ' HG3' ' A' ' 7' ' ' LYS . 65.0 mtm -106.89 -62.09 1.45 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.16 0.505 . . . . 0.0 109.997 177.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -58.49 -56.56 20.61 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.963 -175.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.604 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -64.67 -34.44 78.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.647 -176.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.769 ' HG3' ' HE3' ' A' ' 51' ' ' MET . 34.6 tt0 -62.99 -52.87 61.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.898 0.38 . . . . 0.0 110.025 178.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.427 ' HG3' ' O ' ' A' ' 3' ' ' MET . 45.8 mtpt -64.33 -35.91 82.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.689 -179.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -61.66 -37.78 85.33 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.938 0.399 . . . . 0.0 110.185 174.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.572 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 30.3 t80 -71.43 -39.28 71.15 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.32 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 6' ' ' GLU . 47.5 mm -71.39 -37.7 66.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.281 0.562 . . . . 0.0 110.399 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 38.9 m -72.77 -24.37 60.94 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.193 175.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.761 ' HB2' ' HD2' ' A' ' 37' ' ' ARG . 46.7 ttp -75.18 -33.14 61.41 Favored 'General case' 0 CA--C 1.509 -0.611 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 178.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 9' ' ' PHE . 80.1 mt -68.06 -38.3 82.3 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.108 176.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 62.7 mttt -69.55 -40.38 76.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.256 0.551 . . . . 0.0 111.039 176.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -73.97 -13.32 60.86 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.823 179.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.544 ' OD1' ' HD2' ' A' ' 34' ' ' ARG . 0.9 OUTLIER -106.66 10.82 30.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.841 0.353 . . . . 0.0 110.644 177.546 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 41.9 mm-40 56.37 31.83 19.43 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.014 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.481 HG11 HD22 ' A' ' 13' ' ' LEU . 58.3 t -75.71 140.95 16.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.786 -178.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -157.94 -158.81 0.76 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.026 -0.533 . . . . 0.0 109.597 172.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.7 p -51.23 -32.25 23.52 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.1 t -85.32 25.86 0.96 Allowed 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.42 0.628 . . . . 0.0 111.88 -174.154 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.675 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 3.6 m95 -115.89 140.73 48.95 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.955 0.407 . . . . 0.0 110.873 178.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 84.9 p -97.08 168.49 10.42 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 173.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.472 ' CD1' HD12 ' A' ' 27' ' ' ILE . 41.7 t80 -89.04 15.75 8.19 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 122.172 0.987 . . . . 0.0 108.957 177.081 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.0 m -94.14 -42.9 8.74 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 113.842 -1.526 . . . . 0.0 107.462 170.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.675 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 19.7 ttt180 -60.58 -38.05 83.32 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 113.57 -1.65 . . . . 0.0 109.437 174.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.776 HG23 HD22 ' A' ' 31' ' ' LEU . 50.7 mt -61.15 -58.25 8.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.64 175.223 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 71.3 mt -60.18 -34.78 58.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.543 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.4 t -79.24 -38.85 34.61 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -174.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 26.8 mm-40 -104.05 -34.55 8.39 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 -173.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.776 HD22 HG23 ' A' ' 27' ' ' ILE . 5.1 mp -86.47 -15.06 41.33 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.434 0.635 . . . . 0.0 109.725 -176.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -83.34 -5.53 88.67 Favored Glycine 0 N--CA 1.439 -1.108 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.275 174.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 23.7 p -128.02 -45.44 1.41 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -175.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.544 ' HD2' ' OD1' ' A' ' 16' ' ' ASN . 47.1 mtt180 -53.5 -44.86 69.4 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -177.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.441 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 16.6 t70 -160.34 129.44 3.15 Favored Pre-proline 0 C--N 1.323 -0.559 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 177.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.505 ' O ' ' HG3' ' A' ' 40' ' ' MET . 16.3 Cg_exo -69.46 27.56 0.17 Allowed 'Trans proline' 0 CA--C 1.533 0.438 0 C-N-CA 123.577 2.852 . . . . 0.0 114.851 -171.241 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.761 ' HD2' ' HB2' ' A' ' 12' ' ' MET . 87.1 mtt180 -65.5 -28.42 69.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.122 0.487 . . . . 0.0 110.142 176.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.429 ' CE1' ' HD2' ' A' ' 48' ' ' LYS . 49.9 t80 -69.26 -20.57 63.93 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.461 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 46.4 m95 -103.63 -28.64 11.59 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.524 -175.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.581 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 47.9 mtm -55.56 -41.5 73.37 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.178 0.514 . . . . 0.0 110.207 178.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.604 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 3.4 p -89.91 123.08 41.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 169.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -58.86 143.8 46.41 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-O 121.68 0.752 . . . . 0.0 110.671 -176.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -75.37 98.29 3.82 Favored 'General case' 0 N--CA 1.436 -1.129 0 CA-C-N 114.667 -1.151 . . . . 0.0 113.594 -163.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -106.0 95.97 11.99 Favored Pre-proline 0 C--N 1.317 -0.818 0 N-CA-C 106.868 -1.531 . . . . 0.0 106.868 158.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.852 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 25.9 Cg_exo -62.68 -37.37 57.45 Favored 'Trans proline' 0 N--CA 1.449 -1.147 0 C-N-CA 121.997 1.798 . . . . 0.0 111.997 -173.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.484 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -61.4 -38.75 88.22 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.228 -179.822 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 48.4 t90 -69.25 -38.34 78.41 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-O 120.875 0.369 . . . . 0.0 110.038 173.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.429 ' HD2' ' CE1' ' A' ' 38' ' ' TYR . 23.4 mmtp -60.6 -33.36 72.62 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.363 177.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.852 ' HG3' ' O ' ' A' ' 45' ' ' PRO . 31.7 mtpt -82.54 -38.44 23.74 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.236 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 42.9 mt-10 -61.84 -39.02 90.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.285 0.564 . . . . 0.0 111.271 176.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.769 ' HE3' ' HG3' ' A' ' 6' ' ' GLU . 17.6 ptm -78.79 -26.96 44.45 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-O 121.217 0.532 . . . . 0.0 109.767 -178.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.517 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 33.7 t80 -71.36 -39.28 71.39 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.155 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -74.39 -22.16 59.31 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.546 0.689 . . . . 0.0 109.464 177.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.7 tptm -71.09 -37.51 72.42 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.49 172.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -68.16 -25.84 65.46 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.628 178.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 58.7 mt -86.43 -32.53 20.82 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.309 178.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -89.91 -49.21 6.74 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.131 0.491 . . . . 0.0 110.961 -177.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -86.36 -56.29 3.51 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.74 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 . . . . . 0 C--O 1.247 0.935 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.575 -179.522 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.662 0 N-CA-C 112.134 -0.386 . . . . 0.0 112.134 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.65 40.94 1.14 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.928 0.394 . . . . 0.0 111.002 -177.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 29.6 ttp -74.92 -46.31 36.7 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.12 0.486 . . . . 0.0 110.081 -179.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -66.37 -44.51 82.93 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.846 178.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.429 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -60.03 -42.15 93.76 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.582 176.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -57.97 -46.71 84.7 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.798 177.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.484 ' HE2' ' HA ' ' A' ' 7' ' ' LYS . 5.8 mmpt? -48.72 -57.7 5.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.341 179.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.486 ' HB3' ' HD2' ' A' ' 37' ' ' ARG . 28.2 mt-10 -73.4 -29.85 62.87 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.53 -178.337 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.583 ' HE2' ' HE2' ' A' ' 48' ' ' LYS . 0.4 OUTLIER -58.98 -40.62 85.36 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 177.81 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.537 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 33.4 mm -71.56 -37.08 62.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.339 0.59 . . . . 0.0 110.354 177.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 23.1 m -64.2 -40.8 96.82 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.301 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.471 ' HG2' ' O ' ' A' ' 8' ' ' GLU . 16.4 ptm -75.68 -23.63 56.23 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -177.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 9' ' ' PHE . 85.2 mt -68.77 -39.89 79.98 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.628 174.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.537 ' HD3' ' O ' ' A' ' 10' ' ' ILE . 0.1 OUTLIER -71.56 -39.78 70.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.394 0.616 . . . . 0.0 110.422 177.126 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -75.45 -14.17 60.42 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.597 -0.729 . . . . 0.0 112.546 -175.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.431 ' HA ' HD22 ' A' ' 16' ' ' ASN . 0.8 OUTLIER -107.87 20.18 19.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.834 0.35 . . . . 0.0 110.928 176.274 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 59.79 31.64 20.91 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.339 175.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.493 HG22 ' CE2' ' A' ' 22' ' ' TRP . 51.6 t -78.15 128.85 38.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.029 0.442 . . . . 0.0 111.264 -177.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -150.34 -157.46 0.82 Allowed 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 171.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.8 m -65.46 -9.02 22.07 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.5 p -79.06 -16.92 56.11 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 121.019 0.438 . . . . 0.0 111.199 176.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.597 ' CE2' ' HD3' ' A' ' 26' ' ' ARG . 7.2 m95 -86.86 119.69 27.35 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.281 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.401 ' C ' ' H ' ' A' ' 25' ' ' SER . 5.5 m -83.93 165.49 18.64 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 168.574 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.563 ' CD1' HD12 ' A' ' 27' ' ' ILE . 29.3 t80 -82.46 16.48 2.08 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 122.454 1.121 . . . . 0.0 109.577 -175.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.401 ' H ' ' C ' ' A' ' 23' ' ' SER . 48.1 t -91.4 -31.59 15.97 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-N 113.673 -1.603 . . . . 0.0 107.452 172.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.597 ' HD3' ' CE2' ' A' ' 22' ' ' TRP . 28.7 ttt180 -75.05 -33.32 61.71 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.846 179.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.563 HD12 ' CD1' ' A' ' 24' ' ' PHE . 54.2 mt -66.15 -42.3 90.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.175 176.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.6 mt -74.58 -43.36 48.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 119.561 -0.855 . . . . 0.0 111.808 175.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.2 t -82.4 -38.87 23.47 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -169.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.815 ' O ' ' HB2' ' A' ' 34' ' ' ARG . 28.9 mm-40 -103.89 -35.77 8.03 Favored 'General case' 0 C--O 1.212 -0.902 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.319 -176.701 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.554 HD23 HG23 ' A' ' 27' ' ' ILE . 8.9 tp -87.57 -36.27 17.64 Favored 'General case' 0 C--N 1.315 -0.91 0 O-C-N 123.569 0.543 . . . . 0.0 111.153 -167.049 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.48 -49.35 79.55 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.297 177.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 68.8 p -83.41 -10.08 58.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.048 0.451 . . . . 0.0 111.64 -177.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.815 ' HB2' ' O ' ' A' ' 30' ' ' GLU . 53.2 ttm-85 -83.31 -45.16 14.1 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.051 -177.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.444 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 8.0 t70 -138.09 128.23 15.24 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.583 -176.36 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 20.6 Cg_exo -66.87 -13.06 38.48 Favored 'Trans proline' 0 N--CA 1.465 -0.168 0 C-N-CA 123.517 2.811 . . . . 0.0 113.269 -178.058 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.523 ' HA ' ' HB2' ' A' ' 40' ' ' MET . 79.7 mtm180 -64.54 -19.45 65.63 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -70.3 -24.44 63.02 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 121.082 0.467 . . . . 0.0 109.881 175.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 53.9 m95 -101.6 -18.86 15.71 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.768 -178.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.523 ' HB2' ' HA ' ' A' ' 37' ' ' ARG . 18.3 ttp -52.55 -46.51 66.82 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 121.407 0.622 . . . . 0.0 109.778 175.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.429 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 7.6 p -89.19 133.97 29.83 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 168.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.4 143.01 50.95 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-O 121.334 0.588 . . . . 0.0 109.829 177.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -82.53 97.52 8.48 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.892 -165.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -103.26 101.41 22.29 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 114.691 -1.14 . . . . 0.0 108.45 170.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -59.23 -25.56 78.62 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.872 2.382 . . . . 0.0 112.574 -176.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.411 ' HA ' HD22 ' A' ' 46' ' ' LEU . 0.7 OUTLIER -75.47 -39.3 58.87 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 -179.795 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 47.1 t90 -75.52 -38.38 59.44 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.567 176.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.583 ' HE2' ' HE2' ' A' ' 9' ' ' PHE . 2.8 mptm? -62.66 -33.23 74.62 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 176.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.406 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 24.9 mttm -75.73 -41.43 53.39 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 120.975 -0.29 . . . . 0.0 110.833 176.242 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -61.55 -48.15 82.32 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.226 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 3.5 ppp? -75.28 -27.69 59.49 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.787 -174.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.617 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 35.3 t80 -74.59 -38.97 62.47 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.678 178.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 49' ' ' LYS . 45.2 mt-10 -73.0 -23.05 60.59 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 176.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 31.8 tptt -73.22 -38.45 66.06 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.522 0.677 . . . . 0.0 109.456 172.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.713 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 61.7 t80 -71.75 -23.06 61.54 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.666 -177.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.617 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 56.3 mt -89.5 -33.8 16.64 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.961 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -95.72 -53.32 3.75 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.887 0.375 . . . . 0.0 110.805 -176.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.402 HD22 ' HA ' ' A' ' 58' ' ' ASN . 2.1 t-20 -75.11 -53.38 8.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.018 178.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.713 ' HG2' ' O ' ' A' ' 55' ' ' TYR . 77.1 mtt180 . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.438 -178.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.491 0 N-CA-C 111.603 -0.599 . . . . 0.0 111.603 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.753 ' HB1' ' HB3' ' A' ' 5' ' ' ALA . . . -101.45 97.16 7.66 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.754 0.311 . . . . 0.0 110.519 -177.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 83.1 mtp -92.61 -63.38 1.23 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.025 0.44 . . . . 0.0 109.952 179.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.582 ' O ' ' HG3' ' A' ' 8' ' ' GLU . 23.1 mt-10 -64.1 -40.59 96.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.941 176.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.753 ' HB3' ' HB1' ' A' ' 2' ' ' ALA . . . -63.22 -35.69 81.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.685 -178.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.54 ' O ' HG12 ' A' ' 10' ' ' ILE . 32.6 tt0 -58.8 -51.26 70.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.352 0.596 . . . . 0.0 109.849 174.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.432 ' HE2' ' HB3' ' A' ' 7' ' ' LYS . 51.1 mtpt -63.03 -39.33 94.44 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.012 -179.099 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.582 ' HG3' ' O ' ' A' ' 4' ' ' GLU . 42.5 mt-10 -63.36 -40.23 96.69 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 120.904 0.383 . . . . 0.0 110.066 176.076 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.45 ' HA ' ' HG2' ' A' ' 12' ' ' MET . 48.2 t80 -60.75 -37.83 83.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.104 176.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.628 ' O ' ' HD2' ' A' ' 14' ' ' LYS . 41.0 mm -71.81 -37.08 60.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.387 178.194 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.6 m -66.67 -40.55 88.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.486 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.528 ' SD ' ' HB3' ' A' ' 37' ' ' ARG . 24.3 ptm -73.41 -22.24 60.28 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.512 HD23 ' HG3' ' A' ' 12' ' ' MET . 0.1 OUTLIER -70.45 -37.83 74.39 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.335 176.563 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.628 ' HD2' ' O ' ' A' ' 10' ' ' ILE . 3.8 mptt -68.16 -37.71 81.3 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.321 0.582 . . . . 0.0 109.847 173.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -66.21 -36.78 83.94 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.95 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -88.95 10.12 22.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.056 -179.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 61.71 31.79 18.48 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.37 176.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.479 HG11 HD13 ' A' ' 13' ' ' LEU . 40.2 t -75.75 139.47 18.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.682 0.277 . . . . 0.0 110.871 -177.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.469 ' OD1' HG22 ' A' ' 21' ' ' THR . 4.5 p-10 -156.4 -161.02 1.05 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.023 175.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.686 ' HA ' HD22 ' A' ' 56' ' ' LEU . 69.3 m -60.39 -30.52 69.64 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -175.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.469 HG22 ' OD1' ' A' ' 19' ' ' ASP . 13.2 t -81.19 11.31 4.34 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.991 0.424 . . . . 0.0 111.935 -175.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.449 ' CH2' HD11 ' A' ' 31' ' ' LEU . 5.3 m95 -96.67 138.87 33.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.201 0.525 . . . . 0.0 111.56 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -97.03 154.85 17.07 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 171.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.467 ' HD1' HD12 ' A' ' 27' ' ' ILE . 67.2 t80 -86.19 14.96 5.62 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 122.196 0.998 . . . . 0.0 110.358 -175.303 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.0 m -93.31 -33.31 13.96 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 114.315 -1.311 . . . . 0.0 107.581 168.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -70.13 -36.91 75.12 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 114.05 -1.432 . . . . 0.0 109.512 176.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.725 HG23 HD22 ' A' ' 31' ' ' LEU . 28.4 mt -61.1 -54.95 28.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.244 173.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 68.4 mt -61.55 -37.1 77.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 120.022 -0.671 . . . . 0.0 111.459 179.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.8 t -79.29 -40.94 29.21 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -173.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -99.86 -34.14 10.26 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.851 -175.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.725 HD22 HG23 ' A' ' 27' ' ' ILE . 4.2 mp -84.47 -23.51 29.86 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 -176.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -76.45 -13.34 83.51 Favored Glycine 0 N--CA 1.444 -0.814 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.588 174.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.4 p -114.58 -45.94 2.98 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 -176.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 90.1 mtt-85 -56.38 -44.69 80.46 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -177.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.444 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 9.7 t70 -145.91 130.64 8.93 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-O 120.829 0.347 . . . . 0.0 111.067 -173.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 24.5 Cg_exo -64.66 -4.99 9.39 Favored 'Trans proline' 0 CA--C 1.531 0.375 0 C-N-CA 123.6 2.866 . . . . 0.0 113.744 -178.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.528 ' HB3' ' SD ' ' A' ' 12' ' ' MET . 13.3 mtm180 -55.28 -28.64 54.82 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 176.074 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 70.9 t80 -68.64 -20.21 64.46 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.001 0.429 . . . . 0.0 110.133 178.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 58.7 m95 -107.05 -21.95 12.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.241 -177.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 85.0 mtp -58.17 -42.48 86.13 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.442 0.639 . . . . 0.0 109.341 174.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.679 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 6.7 p -86.21 132.01 33.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.328 -0.851 . . . . 0.0 108.842 169.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.19 143.58 48.54 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-O 121.482 0.658 . . . . 0.0 110.282 179.176 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -94.03 97.71 10.51 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.385 -166.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -105.88 97.83 16.39 Favored Pre-proline 0 N--CA 1.442 -0.862 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 163.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.62 ' HA ' ' HB2' ' A' ' 48' ' ' LYS . 24.2 Cg_exo -63.1 -22.37 73.18 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.65 2.234 . . . . 0.0 112.474 -171.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -74.78 -39.27 61.84 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 177.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . 0.404 ' O ' ' HG2' ' A' ' 51' ' ' MET . 45.3 t90 -72.93 -38.36 66.86 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 173.378 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.62 ' HB2' ' HA ' ' A' ' 45' ' ' PRO . 24.8 mmtp -59.78 -33.66 71.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.185 177.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.599 ' HB3' ' O ' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -87.07 -32.82 19.75 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.509 -178.657 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -67.14 -39.55 86.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.048 0.451 . . . . 0.0 111.131 176.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.499 ' HE3' ' HG3' ' A' ' 6' ' ' GLU . 16.9 ptm -74.79 -26.39 59.71 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.665 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 32.4 t80 -69.37 -36.06 76.45 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.209 173.007 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.511 ' HG2' ' O ' ' A' ' 49' ' ' LYS . 38.0 mm-40 -65.13 -31.95 73.4 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.248 0.547 . . . . 0.0 109.651 175.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -72.99 -38.6 66.59 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.99 177.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.426 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 86.1 t80 -70.02 -20.99 63.24 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.084 -177.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.686 HD22 ' HA ' ' A' ' 20' ' ' SER . 87.1 mt -81.75 -33.24 31.12 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.258 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 37.0 p -100.32 -46.45 5.26 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.9 0.381 . . . . 0.0 111.632 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.416 ' O ' ' HB2' ' A' ' 59' ' ' ARG . 6.8 t30 -89.59 -47.65 7.82 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.705 -176.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.426 ' HG2' ' O ' ' A' ' 55' ' ' TYR . 76.3 mtt180 . . . . . 0 C--O 1.251 1.151 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.231 -173.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.9 0 N-CA-C 111.868 -0.493 . . . . 0.0 111.868 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -108.56 61.31 0.6 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.925 0.393 . . . . 0.0 111.641 -176.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 78.5 mtp -106.65 -97.91 0.35 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 173.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -63.03 -30.82 71.9 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.305 0.574 . . . . 0.0 110.041 177.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.605 ' O ' ' HB2' ' A' ' 9' ' ' PHE . . . -56.18 -56.45 20.72 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.691 177.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.44 ' O ' HG12 ' A' ' 10' ' ' ILE . 28.9 tt0 -71.06 -47.12 60.22 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.972 -178.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.631 ' HE2' ' O ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -42.3 -64.1 0.65 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.772 -1.104 . . . . 0.0 111.305 176.45 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.539 ' HB3' ' HD2' ' A' ' 37' ' ' ARG . 56.0 mm-40 -78.41 -16.71 57.32 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.75 -0.38 . . . . 0.0 112.009 -175.054 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.605 ' HB2' ' O ' ' A' ' 5' ' ' ALA . 21.3 t80 -69.5 -40.04 77.25 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 175.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 6' ' ' GLU . 46.0 mm -74.41 -36.31 41.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 121.551 0.691 . . . . 0.0 109.824 178.011 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 19.9 m -66.92 -33.29 75.27 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.607 178.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 18.1 ttp -76.57 -32.4 58.12 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.107 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.473 HD13 HG11 ' A' ' 18' ' ' VAL . 0.1 OUTLIER -68.43 -38.57 81.3 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.104 179.105 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 14.3 mtpt -68.18 -40.96 82.1 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.012 0.434 . . . . 0.0 110.845 175.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.437 ' CD ' HH22 ' A' ' 37' ' ' ARG . 29.8 mt-10 -67.05 -18.56 65.4 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.078 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -105.05 16.56 25.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.785 178.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 56.28 32.42 20.36 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.527 -0.761 . . . . 0.0 112.682 176.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.473 HG11 HD13 ' A' ' 13' ' ' LEU . 58.1 t -76.41 119.41 24.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.008 0.433 . . . . 0.0 111.288 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -128.58 -156.0 0.73 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.507 172.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.1 p -68.91 -8.72 46.81 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.034 0.445 . . . . 0.0 111.365 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.4 p -79.77 9.66 4.94 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.781 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.682 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 11.7 m95 -117.76 146.2 43.96 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.15 0.5 . . . . 0.0 111.876 -175.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.9 m -110.17 164.93 12.16 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 165.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.682 ' CE1' ' HB3' ' A' ' 48' ' ' LYS . 88.5 t80 -82.99 16.27 2.39 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 122.308 1.051 . . . . 0.0 110.891 -171.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.5 m -92.16 -32.55 15.06 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 113.861 -1.518 . . . . 0.0 107.947 171.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.682 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 42.5 ttt180 -71.07 -35.46 71.9 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.408 -1.269 . . . . 0.0 109.398 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.555 HG12 HD22 ' A' ' 31' ' ' LEU . 54.9 mt -64.62 -54.45 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.867 175.131 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.1 mt -62.23 -40.19 86.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 C-N-CA 119.691 -0.804 . . . . 0.0 111.348 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.6 t -76.96 -39.27 51.22 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -173.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -112.65 -33.28 6.18 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -173.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.555 HD22 HG12 ' A' ' 27' ' ' ILE . 1.6 mp -78.28 -30.27 48.41 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 122.04 -0.413 . . . . 0.0 110.859 -177.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.66 -18.61 64.04 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.731 -0.747 . . . . 0.0 111.969 175.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.0 p -112.06 -27.69 8.29 Favored 'General case' 0 C--O 1.234 0.254 0 O-C-N 122.381 -0.481 . . . . 0.0 111.996 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.9 mtm180 -74.67 -30.48 61.6 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -178.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.467 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 7.9 t70 -151.48 128.97 5.67 Favored Pre-proline 0 C--N 1.329 -0.3 0 C-N-CA 120.199 -0.6 . . . . 0.0 111.185 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 16.3 Cg_exo -69.85 -5.34 16.02 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 123.466 2.777 . . . . 0.0 113.825 -178.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.539 ' HD2' ' HB3' ' A' ' 8' ' ' GLU . 57.7 mtm180 -60.62 -22.28 63.61 Favored 'General case' 0 C--N 1.333 -0.123 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 176.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 69.1 t80 -68.3 -20.62 64.77 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.899 0.381 . . . . 0.0 110.007 176.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 56.7 m95 -105.25 -17.88 14.31 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.4 -176.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 90.5 mmm -57.65 -37.77 73.94 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.324 0.583 . . . . 0.0 109.87 175.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 6.3 p -96.62 141.3 15.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.455 -0.793 . . . . 0.0 108.886 169.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -59.92 143.7 50.85 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-O 121.616 0.722 . . . . 0.0 109.735 175.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -81.56 97.25 7.75 Favored 'General case' 0 C--N 1.301 -1.509 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.089 -171.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -102.05 98.25 9.81 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 170.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -61.41 -30.57 87.31 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.66 2.24 . . . . 0.0 112.699 -173.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.475 ' HA ' HD22 ' A' ' 46' ' ' LEU . 0.6 OUTLIER -72.53 -40.0 67.1 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.742 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . 0.484 ' O ' ' HG2' ' A' ' 51' ' ' MET . 41.8 t90 -73.79 -38.04 64.76 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-N 116.778 -0.192 . . . . 0.0 110.567 176.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.682 ' HB3' ' CE1' ' A' ' 24' ' ' PHE . 2.5 mptm? -63.37 -33.37 75.38 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.289 177.283 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.415 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 23.7 mttm -73.76 -40.6 63.37 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 120.927 0.394 . . . . 0.0 110.19 176.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 42.8 mt-10 -63.23 -44.64 94.68 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.067 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.484 ' HG2' ' O ' ' A' ' 47' ' ' TRP . 13.5 ptm -76.7 -21.61 55.08 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.215 -176.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.409 ' CZ ' HD11 ' A' ' 56' ' ' LEU . 22.5 t80 -76.35 -37.95 56.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.167 176.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 49' ' ' LYS . 37.7 mt-10 -67.56 -30.95 70.72 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 175.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.4 tttt -71.85 -37.69 70.2 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.392 175.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -66.85 -23.72 66.06 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.941 0.4 . . . . 0.0 111.039 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.409 HD11 ' CZ ' ' A' ' 52' ' ' PHE . 67.4 mt -98.6 -33.46 10.96 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.6 t -89.48 -23.32 22.12 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.05 0.453 . . . . 0.0 111.233 -177.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -126.41 -53.06 1.48 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.665 -178.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 . . . . . 0 C--O 1.251 1.164 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.585 -179.688 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.69 0 N-CA-C 111.957 -0.457 . . . . 0.0 111.957 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 61.94 35.28 16.33 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-O 121.159 0.504 . . . . 0.0 110.507 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 12.6 tpt -95.65 -45.76 6.9 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.978 -177.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -65.11 -47.7 76.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.726 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.572 ' HB1' ' HB ' ' A' ' 41' ' ' VAL . . . -59.28 -43.36 92.55 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.58 -1.191 . . . . 0.0 111.265 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.721 ' HG3' ' HE3' ' A' ' 51' ' ' MET . 32.1 tt0 -63.78 -49.55 72.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.014 0.435 . . . . 0.0 110.641 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.46 ' HE2' ' HB3' ' A' ' 7' ' ' LYS . 15.1 ttpt -49.73 -51.45 38.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.362 -0.836 . . . . 0.0 112.122 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -71.32 -33.55 69.75 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.044 -179.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.637 ' O ' HD23 ' A' ' 13' ' ' LEU . 36.2 t80 -61.68 -38.17 86.83 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.133 0.492 . . . . 0.0 110.113 177.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.515 HG12 ' O ' ' A' ' 6' ' ' GLU . 44.4 mm -71.97 -35.91 55.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.349 0.595 . . . . 0.0 110.145 177.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 48.4 m -67.94 -41.5 82.45 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.642 -179.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.555 ' SD ' ' HA ' ' A' ' 9' ' ' PHE . 21.7 ptm -70.44 -28.99 65.46 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -179.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.637 HD23 ' O ' ' A' ' 9' ' ' PHE . 1.8 mm? -68.46 -37.4 80.15 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.022 177.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.412 ' HE3' ' HE1' ' A' ' 55' ' ' TYR . 12.6 mttt -69.73 -38.51 76.91 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.925 175.367 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -68.28 -27.5 66.38 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.768 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.583 ' ND2' ' HG ' ' A' ' 31' ' ' LEU . 94.3 m-20 -90.82 9.5 29.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.216 -179.151 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 57.48 31.35 20.11 Favored 'General case' 0 CA--C 1.526 0.046 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.267 176.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.605 HG21 HD13 ' A' ' 13' ' ' LEU . 66.3 t -74.1 129.45 36.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.605 -175.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -120.57 -162.58 0.95 Allowed 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 170.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.6 p -77.24 -6.45 53.11 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.899 0.38 . . . . 0.0 111.693 -178.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.5 p -81.8 -13.48 57.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.904 0.383 . . . . 0.0 111.459 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.517 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 6.1 m95 -74.2 136.02 42.78 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.704 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.8 t -90.25 156.66 18.14 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 169.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.538 ' CZ ' ' HB3' ' A' ' 48' ' ' LYS . 42.1 t80 -83.49 16.68 2.48 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 122.123 0.963 . . . . 0.0 109.513 -177.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 27.4 t -93.1 -41.7 9.8 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.135 -1.393 . . . . 0.0 107.611 171.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.517 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 54.2 ttt180 -65.25 -34.29 78.02 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.092 -1.413 . . . . 0.0 109.506 176.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.749 HG23 HD22 ' A' ' 31' ' ' LEU . 59.6 mt -62.99 -56.76 15.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.153 174.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.473 HG12 ' O ' ' A' ' 24' ' ' PHE . 40.1 mm -59.59 -38.46 75.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 120.583 -0.447 . . . . 0.0 111.644 179.125 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.8 t -82.16 -38.81 24.13 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -171.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.531 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 8.3 mm-40 -100.55 -35.26 9.58 Favored 'General case' 0 C--O 1.217 -0.657 0 C-N-CA 120.462 -0.495 . . . . 0.0 111.429 -176.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.749 HD22 HG23 ' A' ' 27' ' ' ILE . 4.6 mp -82.19 -20.14 38.42 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -177.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -79.42 -6.79 88.85 Favored Glycine 0 N--CA 1.44 -1.056 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.571 173.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 38.8 p -125.84 -29.16 3.14 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -176.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 41.5 mtt180 -56.85 -52.14 66.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.635 0.255 . . . . 0.0 111.085 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.456 ' OD1' ' HB2' ' A' ' 37' ' ' ARG . 1.8 p30 -154.93 148.96 19.04 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.297 178.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.437 ' O ' ' HG2' ' A' ' 40' ' ' MET . 20.5 Cg_exo -66.74 4.5 1.06 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.682 2.922 . . . . 0.0 114.295 -174.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.456 ' HB2' ' OD1' ' A' ' 35' ' ' ASP . 54.3 mtm180 -59.21 -34.92 72.73 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 117.77 0.259 . . . . 0.0 111.599 178.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -69.2 -17.26 63.77 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 120.899 0.38 . . . . 0.0 110.173 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -102.2 -19.25 15.16 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.725 -179.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.437 ' HG2' ' O ' ' A' ' 36' ' ' PRO . 95.7 mmm -64.11 -51.88 61.86 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 172.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.572 ' HB ' ' HB1' ' A' ' 5' ' ' ALA . 2.6 p -86.58 114.16 25.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.144 -0.934 . . . . 0.0 109.066 171.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -58.4 145.6 37.8 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 122.184 0.993 . . . . 0.0 111.709 -172.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -78.67 96.9 5.65 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 114.081 -1.418 . . . . 0.0 112.071 -170.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -104.14 99.59 17.64 Favored Pre-proline 0 C--N 1.32 -0.704 0 N-CA-C 107.551 -1.278 . . . . 0.0 107.551 165.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -62.47 -24.73 75.59 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 122.354 2.036 . . . . 0.0 113.098 -172.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.44 HD22 ' HA ' ' A' ' 46' ' ' LEU . 0.6 OUTLIER -80.62 -39.53 27.3 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 -179.19 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . 0.492 ' O ' ' HG2' ' A' ' 51' ' ' MET . 44.4 t90 -74.76 -37.83 62.37 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.403 175.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.634 ' HG3' ' CZ ' ' A' ' 9' ' ' PHE . 1.2 mptm? -61.99 -32.27 72.72 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.256 -0.275 . . . . 0.0 110.256 177.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 36.3 mttt -77.62 -39.4 45.51 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 120.841 0.353 . . . . 0.0 110.711 175.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -64.11 -40.08 95.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.037 0.446 . . . . 0.0 111.266 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.721 ' HE3' ' HG3' ' A' ' 6' ' ' GLU . 12.7 ptm -79.13 -21.33 46.7 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.558 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 22.3 t80 -69.9 -37.15 75.91 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.514 -0.551 . . . . 0.0 109.514 173.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -67.01 -30.91 71.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.133 173.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.464 ' HE2' ' OD1' ' A' ' 58' ' ' ASN . 13.7 tptm -71.72 -38.32 70.51 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.253 176.018 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.45 ' O ' ' HA ' ' A' ' 59' ' ' ARG . 32.4 t80 -65.79 -34.13 77.45 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.602 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 76.0 mt -79.24 -32.04 43.73 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 120.943 -0.303 . . . . 0.0 111.511 -179.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.1 p -87.08 -64.0 1.22 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.888 0.375 . . . . 0.0 111.692 178.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.517 ' O ' ' HB2' ' A' ' 59' ' ' ARG . 0.2 OUTLIER -70.45 -47.92 58.36 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.275 -178.214 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.517 ' HB2' ' O ' ' A' ' 58' ' ' ASN . 21.6 mmt180 . . . . . 0 C--O 1.246 0.887 0 O-C-N 123.988 0.805 . . . . 0.0 110.723 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.794 0 N-CA-C 111.996 -0.442 . . . . 0.0 111.996 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.406 ' O ' ' HB2' ' A' ' 6' ' ' GLU . . . -79.92 8.31 7.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.928 0.394 . . . . 0.0 111.459 -179.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 38.4 ttp -87.32 -54.07 4.49 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.308 0.575 . . . . 0.0 109.515 177.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -62.18 -46.1 90.46 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.087 177.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.585 ' CB ' ' HB ' ' A' ' 41' ' ' VAL . . . -63.97 -29.68 70.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.979 -1.009 . . . . 0.0 111.315 -179.434 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.503 ' O ' HG12 ' A' ' 10' ' ' ILE . 12.9 tt0 -60.81 -56.62 19.09 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.417 0.627 . . . . 0.0 110.3 177.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.493 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -58.32 -42.57 87.05 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.806 -1.088 . . . . 0.0 111.374 -178.545 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -62.14 -38.59 89.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.203 0.525 . . . . 0.0 110.478 176.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.543 ' CZ ' ' HG3' ' A' ' 48' ' ' LYS . 14.6 t80 -64.84 -39.58 93.8 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.084 178.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.503 HG12 ' O ' ' A' ' 6' ' ' GLU . 48.1 mm -70.75 -37.77 70.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.138 0.494 . . . . 0.0 110.542 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 35.1 m -68.65 -31.71 71.04 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.332 176.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.486 ' SD ' ' HB3' ' A' ' 35' ' ' ASP . 37.8 ttp -71.78 -33.29 68.47 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 177.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.673 HD22 HD21 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -71.02 -39.84 72.13 Favored 'General case' 0 N--CA 1.439 -0.977 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.935 178.903 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.0 mtpp -64.67 -35.42 80.98 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.178 0.513 . . . . 0.0 110.611 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.502 ' CD ' HH22 ' A' ' 37' ' ' ARG . 29.7 mt-10 -70.63 -22.84 62.48 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.018 178.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -101.98 7.19 41.43 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.415 176.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.414 ' HB3' HE21 ' A' ' 17' ' ' GLN . 6.8 mm100 56.76 31.11 18.86 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 173.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.597 HG11 HD13 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -67.32 143.89 15.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.658 0.742 . . . . 0.0 111.274 -179.969 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.502 ' CG ' ' N ' ' A' ' 20' ' ' SER . 0.0 OUTLIER -148.25 -174.22 4.52 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.848 179.012 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.502 ' N ' ' CG ' ' A' ' 19' ' ' ASP . 4.3 p -58.02 -23.15 53.01 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 120.857 0.36 . . . . 0.0 111.754 -175.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.2 p -77.45 -1.4 30.11 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.707 ' CD2' ' HD3' ' A' ' 26' ' ' ARG . 4.3 m95 -84.94 144.96 28.0 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.927 0.394 . . . . 0.0 110.398 174.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.8 p -102.88 165.78 10.84 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 172.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.501 ' CD1' HD12 ' A' ' 27' ' ' ILE . 30.2 t80 -87.21 15.87 5.8 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 122.48 1.133 . . . . 0.0 108.553 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.2 t -91.43 -38.78 12.36 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 106.633 -1.618 . . . . 0.0 106.633 168.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.707 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 36.9 ttt180 -67.44 -34.5 77.33 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.595 176.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.737 HG23 HD23 ' A' ' 31' ' ' LEU . 52.0 mt -66.61 -42.08 89.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.644 178.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.1 mt -78.64 -33.34 16.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 C-N-CA 119.284 -0.966 . . . . 0.0 111.866 176.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.7 p -87.64 -40.58 14.06 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -171.473 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.633 ' O ' ' HD3' ' A' ' 34' ' ' ARG . 26.2 mm-40 -106.82 -36.56 6.63 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 121.279 0.561 . . . . 0.0 110.219 -176.152 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.737 HD23 HG23 ' A' ' 27' ' ' ILE . 11.5 tp -80.22 -36.17 35.19 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.322 -170.241 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.56 -22.34 76.55 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.087 175.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 35.5 p -101.57 -28.29 12.61 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 122.425 -0.456 . . . . 0.0 111.731 -178.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.633 ' HD3' ' O ' ' A' ' 30' ' ' GLU . 0.5 OUTLIER -63.34 -48.57 77.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.319 179.175 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.496 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 4.8 t70 -139.04 133.92 16.58 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-O 121.056 0.455 . . . . 0.0 111.722 -170.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.496 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 17.1 Cg_exo -68.4 -11.81 33.05 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 123.694 2.93 . . . . 0.0 113.158 -179.078 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.506 ' HA ' ' HG2' ' A' ' 40' ' ' MET . 72.2 mtm180 -62.16 -20.95 64.65 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 177.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -68.32 -21.71 64.74 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.967 0.413 . . . . 0.0 110.165 176.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.443 ' HD1' ' HA ' ' A' ' 36' ' ' PRO . 60.6 m95 -101.86 -17.74 16.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.683 -174.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.506 ' HG2' ' HA ' ' A' ' 37' ' ' ARG . 96.7 mmm -55.49 -37.16 67.46 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.234 0.54 . . . . 0.0 110.371 178.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.585 ' HB ' ' CB ' ' A' ' 5' ' ' ALA . 6.8 p -99.01 134.4 38.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 171.031 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -59.75 142.34 53.43 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-O 121.486 0.66 . . . . 0.0 109.875 177.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -78.8 98.83 6.45 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.008 -0.997 . . . . 0.0 112.547 -163.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -103.65 101.12 22.18 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 114.817 -1.083 . . . . 0.0 108.449 169.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -63.0 -26.61 73.94 Favored 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.855 2.37 . . . . 0.0 112.53 -175.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.543 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 1.1 tm? -75.75 -39.05 57.8 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . 0.482 ' O ' ' HG2' ' A' ' 51' ' ' MET . 45.4 t90 -74.53 -37.06 63.16 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.691 176.246 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.543 ' HG3' ' CZ ' ' A' ' 9' ' ' PHE . 2.3 mptm? -62.07 -32.46 73.0 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.593 -0.443 . . . . 0.0 109.978 175.452 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.559 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 26.9 mttm -72.69 -40.86 65.9 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 120.916 0.388 . . . . 0.0 110.31 174.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.543 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 26.5 mt-10 -66.15 -41.88 89.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.309 -178.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.482 ' HG2' ' O ' ' A' ' 47' ' ' TRP . 12.5 ptm -76.35 -22.05 55.36 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.86 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.503 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 28.2 t80 -75.26 -37.61 60.87 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.134 -0.484 . . . . 0.0 109.721 175.08 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.559 ' HG2' ' O ' ' A' ' 49' ' ' LYS . 79.0 mm-40 -66.35 -29.1 69.21 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 121.199 0.524 . . . . 0.0 109.634 174.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -72.53 -38.43 68.02 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.979 174.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.592 ' CE2' HG13 ' A' ' 18' ' ' VAL . 53.6 t80 -70.72 -23.08 62.38 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.621 -178.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 52' ' ' PHE . 60.7 mt -93.54 -33.25 13.82 Favored 'General case' 0 N--CA 1.441 -0.896 0 C-N-CA 120.646 -0.422 . . . . 0.0 111.795 179.348 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 45.4 t -87.63 -32.44 19.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.8 0.333 . . . . 0.0 111.103 -178.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -109.45 -58.61 2.02 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.326 -0.397 . . . . 0.0 109.997 -178.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.8 ttm180 . . . . . 0 C--O 1.251 1.171 0 O-C-N 124.254 0.971 . . . . 0.0 110.256 -178.333 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.898 0 N-CA-C 112.037 -0.425 . . . . 0.0 112.037 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -83.19 18.14 1.82 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.95 0.405 . . . . 0.0 111.731 -176.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 69.3 mtm -105.53 -66.94 0.95 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.23 0.538 . . . . 0.0 109.737 176.156 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -65.26 -50.85 64.21 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.952 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 9' ' ' PHE . . . -61.67 -29.76 70.29 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.935 -178.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -63.14 -54.12 42.7 Favored 'General case' 0 CA--C 1.509 -0.596 0 CA-C-O 121.354 0.597 . . . . 0.0 110.0 177.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.402 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -54.87 -45.64 74.64 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.668 -1.151 . . . . 0.0 111.815 -179.263 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.54 ' O ' ' HG2' ' A' ' 12' ' ' MET . 53.2 mm-40 -68.13 -35.41 78.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.586 0.232 . . . . 0.0 111.228 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.578 ' CZ ' ' HG3' ' A' ' 48' ' ' LYS . 12.6 t80 -64.22 -38.46 91.11 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.759 177.316 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.536 HD11 ' HE3' ' A' ' 54' ' ' LYS . 24.4 mm -65.53 -37.44 80.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.572 0.701 . . . . 0.0 109.82 173.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.659 ' HA ' ' CE ' ' A' ' 14' ' ' LYS . 32.7 m -69.17 -41.39 77.29 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.546 -178.138 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.54 ' HG2' ' O ' ' A' ' 8' ' ' GLU . 15.8 ptm -73.2 -33.52 65.43 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 -179.548 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.518 HD13 HG21 ' A' ' 18' ' ' VAL . 1.7 mm? -68.51 -38.03 80.57 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.578 179.23 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.659 ' CE ' ' HA ' ' A' ' 11' ' ' THR . 0.0 OUTLIER -83.38 -24.18 32.11 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.817 -178.052 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -72.71 -34.57 67.21 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 120.996 0.426 . . . . 0.0 110.87 172.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.479 ' OD1' ' HG ' ' A' ' 31' ' ' LEU . 1.0 OUTLIER -79.3 10.16 3.96 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.987 179.953 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 55.06 31.67 16.67 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.225 177.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.518 HG21 HD13 ' A' ' 13' ' ' LEU . 53.2 t -75.17 150.14 6.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.602 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.421 ' CG ' ' H ' ' A' ' 20' ' ' SER . 6.9 t70 -168.71 -154.7 0.14 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 171.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.421 ' H ' ' CG ' ' A' ' 19' ' ' ASP . 12.3 m -59.69 -27.15 66.17 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -171.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.4 p -83.91 34.77 0.5 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.439 0.638 . . . . 0.0 111.687 -177.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.656 ' CE3' ' HB3' ' A' ' 26' ' ' ARG . 8.9 m95 -133.88 148.35 51.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.044 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 21.7 m -114.01 169.99 8.61 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 169.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.514 ' CZ ' ' HB3' ' A' ' 48' ' ' LYS . 42.6 t80 -83.89 16.75 2.65 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 122.03 0.919 . . . . 0.0 110.875 -170.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.4 m -93.29 -43.93 8.56 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.096 -1.411 . . . . 0.0 107.995 172.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.656 ' HB3' ' CE3' ' A' ' 22' ' ' TRP . 11.8 ttt180 -59.4 -36.35 75.66 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.52 176.295 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.666 HG23 HD22 ' A' ' 31' ' ' LEU . 65.7 mt -64.48 -58.78 5.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.73 177.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.2 mt -62.92 -41.31 92.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 119.898 -0.721 . . . . 0.0 111.641 -178.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.2 m -78.0 -36.91 48.29 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -175.072 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.57 ' HB2' ' O ' ' A' ' 26' ' ' ARG . 48.1 mm-40 -98.17 -36.82 9.93 Favored 'General case' 0 C--O 1.221 -0.436 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -178.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.666 HD22 HG23 ' A' ' 27' ' ' ILE . 5.3 mp -83.96 -28.44 27.78 Favored 'General case' 0 CA--C 1.508 -0.637 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.372 -171.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.19 -20.24 66.99 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.563 -0.827 . . . . 0.0 111.472 175.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.7 p -108.46 -33.79 6.96 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 178.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.48 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 39.9 mtt180 -58.89 -51.29 70.67 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 120.596 0.236 . . . . 0.0 111.141 178.16 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.474 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 6.2 t70 -139.55 129.38 14.13 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-O 121.042 0.449 . . . . 0.0 111.042 -172.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.474 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 17.1 Cg_exo -68.76 -8.29 22.95 Favored 'Trans proline' 0 CA--C 1.528 0.183 0 C-N-CA 123.539 2.826 . . . . 0.0 113.036 -178.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.63 ' HA ' ' HG3' ' A' ' 40' ' ' MET . 66.1 mtm180 -62.59 -21.57 65.72 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 178.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -66.53 -20.08 65.94 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 177.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.42 ' HD1' ' HA ' ' A' ' 36' ' ' PRO . 60.5 m95 -97.89 -18.05 18.92 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.443 -0.799 . . . . 0.0 112.082 -174.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.63 ' HG3' ' HA ' ' A' ' 37' ' ' ARG . 42.8 mtm -55.63 -49.24 73.37 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.614 0.721 . . . . 0.0 109.605 177.312 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.402 HG21 ' CZ3' ' A' ' 47' ' ' TRP . 4.2 p -99.28 122.67 51.33 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 CA-C-N 114.964 -1.017 . . . . 0.0 108.984 172.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -58.36 146.44 34.64 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-O 121.81 0.814 . . . . 0.0 111.166 -174.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.408 ' HA ' ' NZ ' ' A' ' 48' ' ' LYS . 15.1 p-10 -68.87 95.43 0.69 Allowed 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 114.349 -1.296 . . . . 0.0 112.104 -168.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -102.31 100.44 15.59 Favored Pre-proline 0 N--CA 1.444 -0.738 0 CA-C-N 114.367 -1.288 . . . . 0.0 107.752 169.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -60.81 -29.69 88.71 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 122.209 1.939 . . . . 0.0 112.325 -173.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 2.6 tm? -73.37 -39.94 64.75 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -178.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . 0.402 ' CZ3' HG21 ' A' ' 41' ' ' VAL . 42.3 t90 -77.77 -37.56 48.73 Favored 'General case' 0 C--O 1.222 -0.343 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.611 177.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.578 ' HG3' ' CZ ' ' A' ' 9' ' ' PHE . 1.4 mptm? -62.38 -31.73 72.44 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 177.26 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.4 mttt -77.92 -40.12 40.67 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.69 0.281 . . . . 0.0 111.019 175.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.468 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 27.0 mt-10 -61.86 -46.1 90.9 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.441 0.639 . . . . 0.0 110.664 179.17 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.478 ' SD ' ' CD1' ' A' ' 9' ' ' PHE . 0.7 OUTLIER -71.85 -33.37 68.38 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.712 -177.927 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.458 ' CZ ' HD11 ' A' ' 56' ' ' LEU . 26.1 t80 -70.44 -38.3 74.49 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.513 -178.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 50' ' ' GLU . 11.6 pt-20 -72.28 -22.93 61.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.4 0.619 . . . . 0.0 109.818 178.233 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.697 ' HG2' ' HB2' ' A' ' 58' ' ' ASN . 2.7 tmmm? -72.5 -37.15 68.49 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.278 171.051 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.633 ' OH ' ' HA ' ' A' ' 14' ' ' LYS . 54.9 t80 -66.44 -21.95 66.21 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.961 0.41 . . . . 0.0 110.318 176.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.458 HD11 ' CZ ' ' A' ' 52' ' ' PHE . 60.8 mt -95.37 -35.33 11.8 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 178.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 44.0 t -88.57 -55.43 3.72 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.12 0.486 . . . . 0.0 110.579 -178.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.697 ' HB2' ' HG2' ' A' ' 54' ' ' LYS . 5.6 m120 -77.02 -51.62 10.77 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.348 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.429 HH11 ' HD2' ' A' ' 59' ' ' ARG . 48.7 mtt180 . . . . . 0 C--O 1.248 0.992 0 O-C-N 123.936 0.773 . . . . 0.0 110.629 178.877 . . . . . . . . 1 1 . 1 stop_ save_